data_2jqn_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 2jqn _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 ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -69.61 96.1 0.91 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.711 173.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 pt -92.2 147.32 5.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.751 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 43.2 m-85 -119.79 147.44 44.64 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -170.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -126.79 123.59 37.74 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.553 171.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.0 mt -96.56 130.1 45.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.731 0.3 . . . . 0.0 111.468 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -147.71 174.55 11.69 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.811 176.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.4 t -79.79 143.97 33.97 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.797 0.332 . . . . 0.0 111.301 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -55.92 -44.1 78.01 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.68 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.5 -37.72 57.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 111.927 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.56 -41.64 65.54 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.131 0.491 . . . . 0.0 110.893 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -64.45 -49.44 71.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.976 -0.557 . . . . 0.0 112.166 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -58.03 -39.53 78.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.717 0.294 . . . . 0.0 111.559 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -50.64 71.43 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.954 0.407 . . . . 0.0 111.241 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -41.7 89.3 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.163 0.506 . . . . 0.0 111.402 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.48 -31.08 72.14 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.08 -40.73 78.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -76.41 -30.55 57.49 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.9 1.14 82.81 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.053 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -141.07 146.56 37.3 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.864 0.364 . . . . 0.0 111.966 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -128.04 99.75 5.61 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.12 0.486 . . . . 0.0 110.283 173.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -71.83 163.89 27.0 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.068 0.461 . . . . 0.0 111.563 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.73 111.46 4.2 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.229 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -67.19 158.39 31.43 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.716 0.293 . . . . 0.0 111.645 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.09 -37.12 43.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.975 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.88 -49.04 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 111.292 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.483 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 8.2 m-20 -62.71 -46.23 89.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.57 -33.24 75.45 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.666 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.29 -37.09 86.25 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.978 0.418 . . . . 0.0 111.78 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -81.42 -51.63 8.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.146 0.498 . . . . 0.0 111.291 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 153.46 71.44 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.416 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 68.64 -176.69 0.21 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.897 0.479 . . . . 0.0 111.597 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.66 103.11 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.302 0.572 . . . . 0.0 111.618 -175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.483 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 8.2 p80 -86.55 106.45 17.55 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.23 0.538 . . . . 0.0 112.218 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -91.55 166.31 12.9 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.1 p -142.72 140.58 31.54 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.902 -0.499 . . . . 0.0 112.163 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.03 157.58 34.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.942 176.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.62 -48.3 8.89 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 114.383 0.513 . . . . 0.0 114.383 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.02 -42.67 89.37 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.188 0.518 . . . . 0.0 111.516 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.88 -40.72 91.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.484 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.41 76.49 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.62 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.707 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 13.1 tm0? -56.58 -50.33 72.27 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -58.06 -56.79 17.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.16 0.505 . . . . 0.0 111.837 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 34.3 m -59.78 -31.24 69.5 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.026 0.441 . . . . 0.0 111.115 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' A' ' 107' ' ' PRO . . . -62.68 -45.2 93.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.103 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.517 ' HA ' HG13 ' A' ' 106' ' ' VAL . . . -66.0 -33.71 76.42 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.976 0.417 . . . . 0.0 111.855 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.7 -54.05 6.24 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -106.82 -40.7 5.42 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -169.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.2 m-85 -85.64 2.5 44.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.072 0.463 . . . . 0.0 112.186 -173.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.622 ' HA ' ' HD3' ' A' ' 107' ' ' PRO . 45.0 ptt85 -57.25 141.15 47.65 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.547 175.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.48 -17.81 22.58 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.063 -0.589 . . . . 0.0 113.928 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -87.55 97.45 10.86 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.282 0.563 . . . . 0.0 111.287 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.18 54.12 0.97 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.049 0.452 . . . . 0.0 111.894 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -158.8 36.37 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.42 0.628 . . . . 0.0 110.57 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -95.66 155.42 16.75 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.503 -173.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.1 t -123.75 130.27 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.328 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.1 tp -98.4 103.93 15.92 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.639 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.527 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 79.8 mt -86.89 113.9 23.08 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.51 124.45 40.5 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.926 0.393 . . . . 0.0 111.963 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.0 t -124.65 132.01 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 122.788 0.435 . . . . 0.0 110.887 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' A' ' 64' ' ' GLU . 38.7 mt-10 -79.4 66.1 4.76 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . 34.16 -78.41 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.1 mm-40 73.18 132.72 0.04 OUTLIER Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 123.705 0.802 . . . . 0.0 111.779 -170.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 64' ' ' GLU . 12.8 Cg_exo -70.38 26.16 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.574 2.85 . . . . 0.0 114.903 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.85 59.41 4.12 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.387 0.613 . . . . 0.0 111.756 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.455 ' HA2' ' O ' ' A' ' 70' ' ' LEU . . . -58.76 -11.49 10.99 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 115.751 -0.659 . . . . 0.0 114.062 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.81 -42.32 99.67 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.723 0.409 . . . . 0.0 111.831 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -105.61 -30.95 9.17 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' A' ' 82' ' ' PRO . 57.5 tp -104.7 101.8 11.41 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.954 0.407 . . . . 0.0 110.762 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -114.04 124.04 51.16 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -69.97 80.09 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.567 0.699 . . . . 0.0 109.132 171.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -100.5 137.39 38.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.236 -169.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.484 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -74.81 95.05 2.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.45 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 t -72.74 146.39 46.45 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.088 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 57.22 20.21 5.53 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.843 0.354 . . . . 0.0 111.886 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.03 42.3 99.66 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.351 -176.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.02 -99.69 0.32 Allowed Glycine 0 CA--C 1.531 1.059 0 C-N-CA 120.745 -0.741 . . . . 0.0 114.027 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.484 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -80.11 145.1 32.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -86.31 96.0 9.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.978 0.418 . . . . 0.0 111.6 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.7 129.14 39.19 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HB2' HD11 ' A' ' 70' ' ' LEU . 33.2 Cg_endo -64.76 100.34 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.515 2.143 . . . . 0.0 112.723 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -93.38 126.88 38.75 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.471 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 tp -92.5 116.05 28.64 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.402 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -84.22 22.32 1.24 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -149.77 156.92 38.64 Favored Pre-proline 0 CA--C 1.54 0.569 0 O-C-N 122.28 -0.262 . . . . 0.0 110.552 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.24 140.91 32.7 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.879 2.386 . . . . 0.0 113.852 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -89.45 98.1 11.58 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.079 0.466 . . . . 0.0 111.061 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.55 132.58 47.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.784 0.326 . . . . 0.0 110.754 176.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 98.2 t -59.7 -39.23 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 120.934 0.397 . . . . 0.0 111.302 -178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 64.1 m -68.33 -8.96 44.45 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -88.71 -28.17 20.73 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.031 0.444 . . . . 0.0 110.967 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.3 t -66.37 143.4 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.438 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.453 HG23 ' HG3' ' A' ' 95' ' ' ARG . 93.3 m -74.05 -65.08 0.88 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.723 0.297 . . . . 0.0 111.192 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.453 ' HG3' HG23 ' A' ' 94' ' ' THR . 37.3 mtp85 -148.15 159.55 43.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.143 0.496 . . . . 0.0 111.853 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -110.37 162.1 14.98 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.703 175.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.9 107.77 3.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.619 0.247 . . . . 0.0 111.474 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -60.2 120.1 9.14 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.011 0.434 . . . . 0.0 110.612 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.422 HD11 ' N ' ' A' ' 100' ' ' ASP . 2.8 tm? -111.27 132.88 54.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.196 -172.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.422 ' N ' HD11 ' A' ' 99' ' ' LEU . 4.2 t70 -124.26 -179.27 4.38 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 120.903 0.382 . . . . 0.0 111.499 -177.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.1 mt -94.66 165.76 12.35 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -173.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.566 ' HB3' ' HB2' ' A' ' 108' ' ' GLN . 5.7 p-10 -106.29 -162.99 0.89 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.109 0.481 . . . . 0.0 111.174 174.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.48 -30.59 68.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -89.72 -3.31 58.26 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.82 19.18 68.42 Favored Glycine 0 CA--C 1.525 0.685 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.956 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.517 HG13 ' HA ' ' A' ' 47' ' ' ALA . 74.2 t -99.8 137.76 20.24 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 122.862 0.465 . . . . 0.0 110.927 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.622 ' HD3' ' HA ' ' A' ' 51' ' ' ARG . 76.0 Cg_exo -51.66 101.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.152 1.901 . . . . 0.0 111.15 171.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' ' HB3' ' A' ' 102' ' ' ASP . 8.9 tp-100 -79.26 82.79 5.37 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -167.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.707 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 8.3 mp -83.98 -14.03 51.8 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.785 171.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.14 -41.5 92.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.891 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -83.21 -29.1 28.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 174.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . 0.469 ' HB3' ' HA ' ' A' ' 109' ' ' LEU . 75.8 t60 -76.11 -21.08 57.06 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.891 0.377 . . . . 0.0 111.817 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.7 mt . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 121.151 0.5 . . . . 0.0 111.307 -179.687 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.528 ' O ' ' HA ' ' A' ' 62' ' ' GLU . 74.7 p . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.64 0.257 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.489 HD12 ' HB3' ' A' ' 60' ' ' ALA . 3.8 mm? -83.5 122.86 29.11 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.254 0.549 . . . . 0.0 112.281 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 61' ' ' VAL . 15.6 pt -108.74 143.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.72 171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.505 ' HB3' HD12 ' A' ' 58' ' ' LEU . 40.0 m-85 -120.46 144.53 47.93 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -166.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -150.29 120.13 7.1 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.232 170.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 59.7 mt -92.49 129.74 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.942 0.401 . . . . 0.0 111.928 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -119.51 161.35 20.72 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.067 0.46 . . . . 0.0 111.731 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.5 p -83.51 142.48 30.87 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 166.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -52.22 -37.79 56.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.4 -42.95 67.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.39 -54.65 7.17 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.327 0.584 . . . . 0.0 111.626 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.473 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 50.0 t-105 -68.09 -32.59 73.02 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -64.88 -43.5 92.71 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.58 0.705 . . . . 0.0 110.124 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.26 81.83 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.01 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.67 -45.24 81.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.076 174.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.473 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.4 mttm -58.31 -39.21 78.77 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.011 0.434 . . . . 0.0 110.914 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.16 -30.25 71.33 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.141 0.496 . . . . 0.0 111.614 178.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -88.67 -28.02 20.87 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.817 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.42 -4.51 85.24 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.992 -170.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.598 ' HG3' HD22 ' A' ' 89' ' ' LEU . 46.1 ttp180 -146.16 141.56 27.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.462 0.305 . . . . 0.0 111.27 -178.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -103.73 141.4 36.15 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.137 0.494 . . . . 0.0 110.546 171.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -73.78 -165.27 0.27 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.58 -83.64 1.06 Allowed Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.375 -0.917 . . . . 0.0 111.675 172.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t 163.96 163.31 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.473 1.109 . . . . 0.0 109.426 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.27 57.38 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.244 0.545 . . . . 0.0 110.642 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.0 t -72.72 -55.08 14.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.291 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -51.95 -46.09 64.61 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.95 0.405 . . . . 0.0 111.97 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.18 -25.33 60.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.28 86.15 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.147 0.498 . . . . 0.0 110.932 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.39 -39.81 74.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.293 0.568 . . . . 0.0 110.526 170.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.17 -4.51 18.27 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.681 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -165.6 163.05 19.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.824 0.345 . . . . 0.0 110.986 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -72.9 129.29 36.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.171 0.51 . . . . 0.0 111.399 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -124.14 106.71 10.55 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.121 0.486 . . . . 0.0 111.049 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.423 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 72.3 mt -86.54 175.29 8.41 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.173 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.5 p -128.58 153.63 47.03 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.985 0.421 . . . . 0.0 112.067 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.403 ' H ' ' CG ' ' A' ' 41' ' ' GLN . . . -98.36 -174.13 2.75 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.798 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -46.48 -66.12 1.87 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 114.943 0.737 . . . . 0.0 114.943 -173.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.29 -54.99 40.52 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 121.234 0.54 . . . . 0.0 111.926 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.403 ' CG ' ' H ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.99 -34.53 76.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.419 -177.21 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.98 -46.59 62.04 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.878 0.37 . . . . 0.0 111.093 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.404 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 8.3 tm0? -61.32 -41.82 97.65 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.2 -53.9 48.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 110.664 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.495 HG23 ' CD1' ' A' ' 49' ' ' TRP . 68.6 m -53.09 -38.68 62.78 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.934 0.397 . . . . 0.0 111.436 177.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.529 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -60.37 -39.01 85.69 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.58 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.08 -24.86 34.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.796 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.05 -64.79 1.11 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.149 0.5 . . . . 0.0 112.237 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.495 ' CD1' HG23 ' A' ' 45' ' ' THR . 52.9 m95 -91.65 -24.99 19.35 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' HA ' ' HG3' ' A' ' 53' ' ' GLN . 62.6 m-85 -108.1 17.6 22.13 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -73.09 115.6 12.61 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.81 29.67 54.12 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.135 -0.555 . . . . 0.0 114.154 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.413 ' HG3' ' HA ' ' A' ' 50' ' ' PHE . 83.5 mm-40 -88.38 -163.74 1.01 Allowed 'General case' 0 N--CA 1.473 0.716 0 O-C-N 122.446 -0.444 . . . . 0.0 111.586 177.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.32 136.08 31.19 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.526 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 55.25 81.31 0.11 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.0 mt -109.09 119.86 40.82 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.473 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.457 HG11 ' CD1' ' A' ' 13' ' ' TRP . 21.5 t -104.99 116.61 49.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 120.831 0.348 . . . . 0.0 111.182 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.505 HD12 ' HB3' ' A' ' 5' ' ' TYR . 63.4 tp -88.17 111.53 21.72 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.784 0.326 . . . . 0.0 111.18 178.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.8 mt -83.45 119.28 24.47 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.802 0.334 . . . . 0.0 110.836 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.489 ' HB3' HD12 ' A' ' 3' ' ' LEU . . . -116.02 96.25 5.49 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.108 0.48 . . . . 0.0 111.157 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.487 ' O ' HG12 ' A' ' 4' ' ' ILE . 36.5 t -106.08 139.27 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.528 ' HA ' ' O ' ' A' ' 2' ' ' THR . 24.5 mt-10 -89.81 127.21 35.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.974 -0.454 . . . . 0.0 110.512 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -36.37 -52.33 0.83 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 68.97 133.82 0.04 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 CA-C-O 120.868 0.366 . . . . 0.0 111.653 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.05 53.3 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 122.553 2.169 . . . . 0.0 112.888 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.09 -23.22 67.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.868 0.467 . . . . 0.0 112.201 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 139.48 -88.69 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.325 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -149.81 25.84 0.83 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 122.129 0.966 . . . . 0.0 109.928 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.56 -42.87 98.32 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.544 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.539 HD12 ' HB2' ' A' ' 82' ' ' PRO . 17.8 tp -100.25 105.8 17.4 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.049 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -103.56 107.88 18.92 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.901 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 71.7 m95 -73.54 112.53 9.71 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.811 0.338 . . . . 0.0 111.395 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.544 ' HB2' ' CE1' ' A' ' 83' ' ' HIS . 36.5 mt-10 -139.53 134.19 31.86 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.094 0.473 . . . . 0.0 111.065 -178.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.816 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -70.32 96.53 1.14 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.035 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m -69.41 -23.87 63.77 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.856 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -118.95 28.34 8.34 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.719 0.295 . . . . 0.0 111.411 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.24 -80.75 0.72 Allowed Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.974 -0.631 . . . . 0.0 113.393 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.92 49.04 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.911 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -85.25 121.6 28.23 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.575 -0.368 . . . . 0.0 111.679 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.816 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 63.3 mtm180 -85.73 149.55 25.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.005 0.431 . . . . 0.0 111.407 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -136.28 126.01 16.03 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.402 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.539 ' HB2' HD12 ' A' ' 70' ' ' LEU . 49.0 Cg_endo -68.78 111.94 2.75 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 122.4 2.067 . . . . 0.0 112.495 175.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.544 ' CE1' ' HB2' ' A' ' 73' ' ' GLU . 53.5 m170 -91.45 137.36 32.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.857 0.361 . . . . 0.0 111.789 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -117.17 118.82 33.36 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.844 0.354 . . . . 0.0 110.231 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -96.24 37.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 -164.3 155.13 13.31 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.336 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.519 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 18.2 Cg_endo -58.02 148.36 77.42 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.381 2.054 . . . . 0.0 112.92 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.81 103.39 15.95 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.101 0.476 . . . . 0.0 111.862 -172.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.598 HD22 ' HG3' ' A' ' 21' ' ' ARG . 73.8 mt -66.27 141.19 58.11 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.981 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.22 -36.21 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.274 0.559 . . . . 0.0 110.413 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.4 m -71.88 -0.23 10.79 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.938 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 4.9 tp10 -97.14 -17.43 19.92 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.202 0.525 . . . . 0.0 110.592 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.478 ' HA ' HG23 ' A' ' 61' ' ' VAL . 57.3 t -78.53 121.55 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.086 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.448 HG22 ' HG3' ' A' ' 62' ' ' GLU . 12.9 m -67.68 -56.42 9.41 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.826 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -139.8 162.62 34.7 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.064 0.459 . . . . 0.0 111.705 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.445 ' CD ' ' HZ2' ' A' ' 17' ' ' LYS . 12.5 pt-20 -150.37 158.64 44.38 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.5 177.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.47 122.37 3.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 104.91 6.66 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.91 0.386 . . . . 0.0 110.998 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.565 ' O ' HD21 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -131.42 91.82 3.07 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.321 1.057 . . . . 0.0 110.883 177.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -91.13 90.75 7.95 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.832 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.0 mt 62.65 -170.46 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 173.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -154.73 -164.98 1.94 Allowed 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.4 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.68 -29.81 28.59 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -98.85 4.13 47.46 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.133 -0.354 . . . . 0.0 111.887 -174.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.92 9.31 87.22 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.576 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.7 t -121.92 134.55 24.74 Favored Pre-proline 0 CA--C 1.54 0.581 0 O-C-N 122.596 -0.355 . . . . 0.0 110.809 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.529 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.8 Cg_endo -62.04 100.98 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 121.959 1.773 . . . . 0.0 112.192 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -70.27 78.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.208 0.528 . . . . 0.0 112.346 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.404 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 9.8 mp -65.45 -18.54 65.39 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 176.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.85 -36.37 41.53 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 121.265 -0.493 . . . . 0.0 113.504 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -79.85 -34.83 39.03 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.999 0.428 . . . . 0.0 111.542 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -83.3 -25.69 31.31 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -172.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 mt . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 121.436 0.636 . . . . 0.0 111.135 -179.109 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.465 ' OG1' ' HB1' ' A' ' 63' ' ' ALA . 46.5 p . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 111.398 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 62' ' ' GLU . 88.0 mt -127.9 141.64 51.49 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.148 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.487 HG23 ' HB2' ' A' ' 63' ' ' ALA . 23.0 pt -110.66 139.31 34.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.897 0.379 . . . . 0.0 111.19 177.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.415 ' HB3' HD12 ' A' ' 58' ' ' LEU . 66.0 m-85 -122.13 136.2 54.88 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.922 0.391 . . . . 0.0 111.631 -175.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.479 ' HD2' ' HG ' ' A' ' 36' ' ' LEU . 57.3 tttp -138.9 113.42 8.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.001 0.429 . . . . 0.0 111.158 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.3 mt -85.31 140.13 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -161.07 160.71 30.79 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.68 0.276 . . . . 0.0 110.914 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 t -70.23 151.42 45.37 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.786 0.327 . . . . 0.0 111.173 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.05 -28.35 66.37 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.786 0.327 . . . . 0.0 110.322 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.95 99.11 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.234 175.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -67.73 -46.9 70.85 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.248 0.547 . . . . 0.0 110.715 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 30.6 t-105 -60.27 -49.7 76.56 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.467 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.72 -30.72 71.78 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.46 86.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.313 0.577 . . . . 0.0 110.984 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.28 66.86 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.18 0.514 . . . . 0.0 111.371 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.513 ' HA ' HG12 ' A' ' 90' ' ' VAL . 28.3 ttpp -67.3 -27.43 67.17 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.538 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -46.34 87.96 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.939 0.4 . . . . 0.0 111.272 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -84.14 -19.86 33.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.432 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.2 -0.35 63.9 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 121.365 -0.445 . . . . 0.0 113.623 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -140.33 138.3 34.8 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.272 0.558 . . . . 0.0 112.141 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -104.22 95.98 6.33 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.319 173.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -85.15 -1.93 57.45 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.219 0.533 . . . . 0.0 110.626 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.47 149.27 9.51 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.86 -0.609 . . . . 0.0 113.178 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.9 m -73.93 -179.56 3.79 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 122.626 -0.338 . . . . 0.0 110.294 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.91 -47.82 16.24 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -68.53 -55.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -54.74 -51.75 64.66 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.35 -36.76 83.22 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.53 -38.21 77.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.105 0.479 . . . . 0.0 111.472 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -78.49 -33.63 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.168 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.22 -5.92 84.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.241 -0.504 . . . . 0.0 112.207 -175.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.427 ' HD1' ' HA ' ' A' ' 85' ' ' TYR . 31.6 m-85 -124.49 111.93 16.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.473 0.309 . . . . 0.0 110.506 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.44 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 64.8 mt -62.32 113.25 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 120.967 0.413 . . . . 0.0 111.199 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -104.21 123.87 48.1 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 112.076 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.604 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 3.8 mp -110.48 166.7 10.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.206 -179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.3 m -111.05 116.5 31.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.864 0.364 . . . . 0.0 110.799 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.72 131.35 34.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -175.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.19 -127.81 42.47 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.041 0.776 . . . . 0.0 115.041 170.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.49 -19.21 65.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.84 0.352 . . . . 0.0 111.845 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.54 -29.02 66.51 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 110.716 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.8 -44.39 81.38 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.124 0.487 . . . . 0.0 110.817 175.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -61.32 -41.05 96.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.077 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 31.7 tt0 -60.7 -49.94 75.49 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.696 0.284 . . . . 0.0 110.624 174.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.0 m -57.24 -35.61 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.023 0.44 . . . . 0.0 110.933 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.18 88.16 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.0 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.41 -9.96 57.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 116.31 -0.405 . . . . 0.0 112.018 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 44' ' ' GLU . 33.9 mmtp -90.17 -61.18 1.74 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.101 0.477 . . . . 0.0 111.834 177.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -110.16 -40.12 4.8 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.469 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 99.9 m-85 -96.79 16.94 17.75 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -169.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.17 141.33 41.89 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.056 0.455 . . . . 0.0 111.8 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.14 23.17 65.86 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 114.461 0.545 . . . . 0.0 114.461 175.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.469 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 74.3 mt-30 -98.85 144.61 27.86 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.429 0.615 . . . . 0.0 111.424 177.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.28 142.25 27.82 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.4 81.31 0.18 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.048 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.2 mt -114.36 151.96 32.21 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.15 0.5 . . . . 0.0 111.75 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 49.5 t -130.46 142.81 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.783 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.9 tp -111.39 104.63 13.09 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.944 0.402 . . . . 0.0 110.648 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 93' ' ' VAL . 84.8 mt -79.9 108.38 13.43 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.913 0.387 . . . . 0.0 111.03 177.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.443 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -108.18 118.02 35.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.889 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.6 t -125.53 143.64 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.433 ' HA ' HD23 ' A' ' 3' ' ' LEU . 46.6 tt0 -72.53 125.36 27.24 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 110.839 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.487 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -82.01 37.61 0.49 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -176.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.81 117.23 39.83 Favored Pre-proline 0 CA--C 1.544 0.748 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -46.28 83.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.118 3.212 . . . . 0.0 114.596 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 mp -54.03 -56.26 19.63 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.687 0.755 . . . . 0.0 109.869 171.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.24 -136.71 2.05 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.834 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 37.8 tt0 -93.51 5.87 50.14 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.297 0.57 . . . . 0.0 111.139 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -81.2 -45.76 15.85 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 tp -81.13 103.07 10.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.989 0.423 . . . . 0.0 110.912 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.643 ' HE3' ' HB2' ' A' ' 73' ' ' GLU . 35.9 ttpt -114.01 117.61 31.81 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.827 0.346 . . . . 0.0 111.912 -177.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -71.57 98.17 1.83 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.096 0.474 . . . . 0.0 109.827 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.643 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -98.53 129.88 45.1 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.23 84.15 6.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.076 0.465 . . . . 0.0 110.021 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.5 m -61.08 106.54 0.61 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -176.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 66.32 -75.51 0.05 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.46 0.704 . . . . 0.0 111.807 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.26 -159.11 33.84 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.774 177.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.84 39.76 2.43 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.344 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.404 ' HB1' ' CE2' ' A' ' 81' ' ' PHE . . . -91.08 108.22 19.72 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.56 -0.377 . . . . 0.0 111.413 -177.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -75.58 92.74 2.94 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' CE2' ' HB1' ' A' ' 79' ' ' ALA . 65.5 m-85 -117.51 109.45 41.91 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 120.912 0.387 . . . . 0.0 111.91 177.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.604 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 55.2 Cg_endo -68.9 122.43 9.34 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.695 2.263 . . . . 0.0 112.515 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -115.19 120.35 39.44 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.41 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.44 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 16.2 mt -88.62 120.15 29.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.059 0.457 . . . . 0.0 111.7 176.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.427 ' HA ' ' HD1' ' A' ' 33' ' ' PHE . 4.4 m-85 -82.86 13.36 3.95 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.351 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -133.54 145.66 57.26 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.212 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -62.91 134.14 45.03 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.356 2.037 . . . . 0.0 111.845 171.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.3 tp -93.42 107.53 19.35 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.4 135.21 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.217 -0.302 . . . . 0.0 110.482 174.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.513 HG12 ' HA ' ' A' ' 17' ' ' LYS . 18.9 m -60.53 -30.36 46.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.96 0.409 . . . . 0.0 111.874 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -63.94 -18.02 63.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.598 176.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -90.57 -19.84 23.29 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.634 -177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.464 HG13 HD21 ' A' ' 59' ' ' LEU . 58.9 t -61.99 115.73 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 120.647 0.261 . . . . 0.0 110.998 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 27.9 m -53.36 -45.38 69.14 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -162.39 146.76 12.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.178 0.513 . . . . 0.0 112.021 174.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -101.78 95.47 6.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.535 0.683 . . . . 0.0 110.199 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.487 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -77.91 137.74 38.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.761 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -75.66 149.11 38.23 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.471 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.655 HD23 ' HB3' ' A' ' 107' ' ' PRO . 29.5 tp -140.07 133.24 29.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -123.77 171.12 9.87 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.296 0.57 . . . . 0.0 111.861 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.72 149.55 27.19 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.742 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -96.64 -161.4 0.87 Allowed 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.099 0.476 . . . . 0.0 111.41 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.15 -23.57 67.16 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -94.04 -9.99 34.95 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.139 -0.351 . . . . 0.0 111.544 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.01 22.01 60.12 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.242 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.1 t -100.5 130.27 26.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 O-C-N 122.722 -0.281 . . . . 0.0 111.134 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.655 ' HB3' HD23 ' A' ' 99' ' ' LEU . 45.8 Cg_exo -57.72 104.94 0.18 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.369 2.046 . . . . 0.0 112.212 174.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -75.51 100.18 4.45 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.49 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.4 mp -100.09 -19.91 16.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.074 176.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.4 -44.85 28.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.245 -176.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -72.0 -30.48 65.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -34.48 72.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 178.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 25.1 mt . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 121.171 0.51 . . . . 0.0 111.934 -175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 80.7 mt -122.23 134.53 54.7 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.929 -174.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.478 HD12 HD12 ' A' ' 36' ' ' LEU . 18.5 pt -121.63 142.44 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 121.02 0.438 . . . . 0.0 111.217 176.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -124.68 145.72 49.52 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.151 0.501 . . . . 0.0 112.263 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.675 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 58.6 tttm -135.27 126.94 29.03 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.052 171.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 64.4 mt -93.67 135.62 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.651 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.524 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 pt? -156.47 173.46 16.87 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.627 0.251 . . . . 0.0 110.948 177.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.6 p -77.62 150.74 34.61 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.709 0.29 . . . . 0.0 110.702 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -56.37 -39.36 72.79 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.133 0.492 . . . . 0.0 111.081 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.3 95.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.073 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.59 -44.37 96.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.147 0.498 . . . . 0.0 110.839 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.433 ' CH2' HG12 ' A' ' 90' ' ' VAL . 26.5 t-105 -63.78 -63.81 1.06 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.248 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -29.44 67.65 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.19 -47.51 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.145 0.497 . . . . 0.0 111.095 174.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.9 -30.29 65.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HA ' HG11 ' A' ' 90' ' ' VAL . 39.4 ttmt -56.11 -50.87 69.85 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.321 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.01 80.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.202 0.525 . . . . 0.0 111.358 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -72.44 -24.53 61.22 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.77 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.63 -11.59 13.34 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.261 -177.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -124.86 144.3 50.38 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.508 -0.407 . . . . 0.0 111.965 -176.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.675 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 63.3 t80 -149.19 111.18 4.6 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.067 0.46 . . . . 0.0 111.205 173.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.84 -4.0 44.5 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 122.181 -0.324 . . . . 0.0 111.84 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.63 -176.99 16.91 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.98 -0.628 . . . . 0.0 113.111 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.4 p -100.3 178.9 4.63 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.759 -0.26 . . . . 0.0 110.356 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.8 -27.79 19.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.137 0.494 . . . . 0.0 111.156 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -68.59 -52.93 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.094 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -58.79 -40.46 84.1 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.89 -26.71 67.75 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.476 175.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.31 -47.07 52.69 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.804 0.335 . . . . 0.0 111.218 175.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -64.74 -34.27 77.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.178 0.514 . . . . 0.0 111.406 174.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 93.57 10.67 58.95 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.077 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -164.18 147.99 9.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.0 mt -64.74 109.09 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.064 0.459 . . . . 0.0 110.482 176.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -74.97 87.67 2.33 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.343 0.592 . . . . 0.0 111.802 -177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.478 HD12 HD12 ' A' ' 4' ' ' ILE . 80.5 mt -84.52 173.46 10.81 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.345 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 69.0 m -148.69 144.63 27.25 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.947 0.403 . . . . 0.0 111.238 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.5 163.13 28.12 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.342 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -45.55 -47.89 12.32 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.385 -0.436 . . . . 0.0 113.799 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG3' ' HG3' ' A' ' 41' ' ' GLN . 8.1 pt-20 -52.15 -51.79 55.78 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 5.0 mt-30 -74.67 -32.44 62.22 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.981 0.419 . . . . 0.0 111.358 -175.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.45 -49.56 74.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.16 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.492 ' HB2' HD21 ' A' ' 109' ' ' LEU . 56.2 tt0 -67.3 -41.07 85.98 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.377 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.19 -51.91 67.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.965 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -56.37 -38.83 71.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.315 0.579 . . . . 0.0 110.779 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -67.68 -27.68 67.05 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.688 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.34 -41.12 18.59 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -78.53 -42.26 29.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -105.52 -58.18 1.93 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -171.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.506 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 95.5 m-85 -91.11 12.69 19.14 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.51 119.73 12.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.045 0.45 . . . . 0.0 112.19 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.68 -0.49 65.18 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.756 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.486 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 65.7 mt-30 -92.97 116.06 28.7 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 117.158 0.479 . . . . 0.0 111.194 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.34 39.79 1.11 Allowed 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -132.36 17.54 4.45 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.744 0.307 . . . . 0.0 111.195 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 50' ' ' PHE . 14.1 mt -94.54 124.54 38.64 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -171.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.412 ' O ' HD22 ' A' ' 8' ' ' LEU . 95.6 t -98.85 130.1 48.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.084 169.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.452 HD23 HD23 ' A' ' 99' ' ' LEU . 54.3 tp -97.87 109.37 22.14 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 110.672 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.9 mt -81.02 104.65 11.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.831 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' A' ' 95' ' ' ARG . . . -94.55 93.81 7.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.155 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.732 HG22 HG12 ' A' ' 93' ' ' VAL . 22.3 t -112.26 138.18 42.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.966 -176.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.488 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 39.3 mt-10 -83.77 156.11 22.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.778 0.323 . . . . 0.0 110.304 173.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.38 59.8 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.914 0.388 . . . . 0.0 111.222 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.5 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 3.8 mm-40 -64.79 -51.42 57.77 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.975 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.5 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 89.3 Cg_exo -49.86 -56.13 3.43 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.613 2.209 . . . . 0.0 113.97 177.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.638 HD23 HD13 ' A' ' 84' ' ' LEU . 3.2 pp -81.84 -1.12 46.45 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -175.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.23 -155.5 47.55 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.055 -0.593 . . . . 0.0 113.827 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -94.27 14.11 21.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.9 -17.08 64.73 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.062 0.458 . . . . 0.0 111.033 175.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.8 tp -72.46 125.43 27.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.797 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -102.51 121.43 42.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.737 0.303 . . . . 0.0 111.385 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -89.04 131.42 35.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -137.3 103.28 5.05 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.166 0.508 . . . . 0.0 111.845 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HB3' ' HG2' ' A' ' 80' ' ' ARG . . . -82.47 79.34 8.94 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.053 0.454 . . . . 0.0 110.936 175.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.4 m -68.01 -21.07 65.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.031 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.6 143.52 50.97 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.659 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -51.74 105.14 0.2 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.497 -0.383 . . . . 0.0 113.558 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.83 -30.9 9.37 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.348 -0.454 . . . . 0.0 113.423 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -91.05 99.11 12.2 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.209 0.528 . . . . 0.0 111.674 -177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.437 ' HG2' ' HB3' ' A' ' 74' ' ' ALA . 20.2 mtm180 -91.01 101.26 14.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.532 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -90.86 114.81 62.67 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -173.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.84 131.33 12.13 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.528 2.152 . . . . 0.0 112.432 174.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -127.23 129.12 47.17 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.638 HD13 HD23 ' A' ' 66' ' ' LEU . 7.1 mt -106.09 111.57 24.25 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.412 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -83.53 10.78 8.21 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.725 0.298 . . . . 0.0 111.637 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -137.77 147.61 57.62 Favored Pre-proline 0 N--CA 1.472 0.638 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.72 135.16 65.3 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.883 2.389 . . . . 0.0 113.519 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.0 tp -94.39 131.75 39.73 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -89.56 136.15 33.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.759 0.314 . . . . 0.0 110.817 177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.515 HG11 ' HA ' ' A' ' 17' ' ' LYS . 95.2 t -57.4 -34.37 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 121.263 0.554 . . . . 0.0 110.83 176.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 59.1 p -67.72 -13.49 62.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.945 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -90.4 -21.42 21.96 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 120.901 0.381 . . . . 0.0 111.396 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.732 HG12 HG22 ' A' ' 61' ' ' VAL . 85.4 t -64.79 145.31 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 72.1 m -85.47 -68.68 0.71 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.509 ' HB3' ' HB1' ' A' ' 60' ' ' ALA . 74.3 ttt180 -126.17 146.75 49.83 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -110.28 124.78 52.26 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.048 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -139.96 108.19 5.79 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.02 128.96 38.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.818 0.342 . . . . 0.0 110.26 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.452 HD23 HD23 ' A' ' 58' ' ' LEU . 86.8 mt -78.19 90.63 4.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -174.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -78.49 99.94 6.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.156 0.503 . . . . 0.0 110.493 170.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.74 150.82 28.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.189 0.519 . . . . 0.0 111.928 -178.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -138.38 171.22 14.7 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.906 -170.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.56 -83.5 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 177.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -90.65 -11.75 38.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.042 0.448 . . . . 0.0 111.267 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.15 26.68 33.16 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.478 -175.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.73 126.21 36.2 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 122.356 0.262 . . . . 0.0 110.908 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.16 140.56 49.66 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.406 2.071 . . . . 0.0 112.853 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -84.11 87.77 7.16 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.347 0.594 . . . . 0.0 112.208 -175.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.492 HD21 ' HB2' ' A' ' 43' ' ' GLN . 11.1 mp -93.96 -4.53 49.57 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.973 -0.454 . . . . 0.0 112.163 176.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.45 74.8 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.611 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 -28.93 61.36 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.324 0.583 . . . . 0.0 111.166 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -72.71 -46.08 55.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.132 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.9 mt . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -172.69 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.12 119.3 31.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.679 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' HB ' HD12 ' A' ' 36' ' ' LEU . 26.6 pt -93.69 146.45 6.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 110.85 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.505 ' HB3' HD12 ' A' ' 58' ' ' LEU . 89.0 m-85 -126.14 133.67 51.54 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.121 0.486 . . . . 0.0 112.192 -174.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.499 ' HZ2' HD13 ' A' ' 8' ' ' LEU . 47.0 tttm -130.5 117.27 19.37 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.907 174.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pp -84.3 139.37 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.901 0.381 . . . . 0.0 111.21 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.499 HD13 ' HZ2' ' A' ' 6' ' ' LYS . 2.2 pt? -165.96 156.47 12.93 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.933 0.397 . . . . 0.0 111.682 177.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.9 m -69.83 140.1 53.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.613 175.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -49.98 -38.34 36.51 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.24 -46.32 62.29 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 176.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.9 -43.87 82.27 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.799 0.333 . . . . 0.0 111.177 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.53 ' CH2' HG22 ' A' ' 90' ' ' VAL . 28.1 t-105 -63.08 -53.14 58.33 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -28.5 69.72 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 122.394 -0.191 . . . . 0.0 111.485 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.68 -52.27 63.95 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.071 0.462 . . . . 0.0 110.777 173.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.97 78.79 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.141 0.496 . . . . 0.0 111.14 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -66.33 -38.03 86.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.11 84.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.172 0.51 . . . . 0.0 110.831 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -71.41 -27.95 63.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.428 0.633 . . . . 0.0 110.613 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.15 4.58 89.79 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.938 -173.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.548 ' HB2' HD13 ' A' ' 89' ' ' LEU . 36.1 ttt180 -154.47 139.29 17.14 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -173.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.494 ' CZ ' ' HE3' ' A' ' 6' ' ' LYS . 83.8 t80 -122.44 140.31 52.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -154.85 74.34 0.92 Allowed 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.695 0.759 . . . . 0.0 111.763 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.26 117.17 1.14 Allowed Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.844 -0.616 . . . . 0.0 113.458 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.438 ' N ' ' HB2' ' A' ' 28' ' ' ASP . 70.1 m -70.43 -179.94 2.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 122.638 -0.331 . . . . 0.0 110.842 175.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -46.22 -49.9 16.54 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.211 0.529 . . . . 0.0 111.794 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.8 t -70.68 -51.74 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.438 ' HB2' ' N ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -54.83 -53.17 58.77 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.839 0.456 . . . . 0.0 112.193 -178.144 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 45.8 tp -62.48 -36.64 83.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.949 0.404 . . . . 0.0 111.125 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -18.29 61.03 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.906 0.384 . . . . 0.0 111.888 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.03 -47.2 7.99 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.878 0.371 . . . . 0.0 111.573 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 150.0 -40.74 0.84 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.217 -0.516 . . . . 0.0 112.825 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -150.56 178.49 9.02 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.706 0.289 . . . . 0.0 111.199 -177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -85.83 125.04 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-O 121.011 0.434 . . . . 0.0 111.549 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -107.65 90.88 3.43 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.375 0.607 . . . . 0.0 111.334 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.607 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 80.9 mt -79.55 170.78 16.06 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.194 0.521 . . . . 0.0 111.805 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -132.23 119.37 20.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.63 101.81 8.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.68 -91.85 0.01 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.489 0.556 . . . . 0.0 114.489 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -45.95 -54.95 7.45 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.025 0.53 . . . . 0.0 111.699 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -63.73 -25.03 68.01 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.732 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.18 -54.6 9.19 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.635 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.52 HE21 ' HB2' ' A' ' 108' ' ' GLN . 52.6 tt0 -67.92 -30.81 70.22 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.684 0.278 . . . . 0.0 111.672 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.25 -46.46 77.04 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.627 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.1 m -60.38 -38.58 84.36 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.063 0.459 . . . . 0.0 110.837 175.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.316 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -77.23 -25.67 51.86 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.928 0.394 . . . . 0.0 111.567 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -82.42 -70.62 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.164 0.507 . . . . 0.0 112.237 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -88.02 -32.64 18.7 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.518 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 88.0 m-85 -101.13 14.36 32.22 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 2.4 tmt_? -58.39 101.91 0.1 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.356 0.598 . . . . 0.0 111.429 -177.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.69 21.72 30.55 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.294 176.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.518 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 76.5 mt-30 -90.94 -179.28 5.44 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.425 0.613 . . . . 0.0 111.438 173.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.5 160.03 35.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -176.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.416 ' N ' HD21 ' A' ' 55' ' ' ASN . 0.9 OUTLIER 61.98 31.07 18.14 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.287 178.002 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.3 mt -76.85 98.32 4.83 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.453 0.644 . . . . 0.0 111.207 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.447 ' O ' HD22 ' A' ' 8' ' ' LEU . 61.0 t -83.7 125.78 40.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.804 176.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HB3' ' HB1' ' A' ' 97' ' ' ALA . 55.2 tp -94.01 101.62 13.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 174.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 91.5 mt -75.17 109.64 8.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.695 0.283 . . . . 0.0 111.194 178.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.27 114.45 28.74 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.563 176.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 93' ' ' VAL . 43.4 t -126.71 127.99 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.53 90.98 2.25 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.519 0.676 . . . . 0.0 111.16 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.69 42.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.307 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 65.7 158.89 0.13 Allowed Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.579 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.9 76.55 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.902 2.401 . . . . 0.0 112.918 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.4 mt -66.98 -65.23 0.71 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.72 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 145.46 -90.65 0.15 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 120.544 -0.836 . . . . 0.0 114.017 177.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -85.02 -42.57 14.74 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -173.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.414 ' HB2' ' HG2' ' A' ' 86' ' ' ARG . 24.7 p-10 -75.45 -41.97 54.43 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 111.805 -173.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.5 tp -85.96 96.49 9.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.219 0.533 . . . . 0.0 109.83 170.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.419 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 25.5 tptp -107.54 101.97 11.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.492 -171.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -78.27 103.3 8.12 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.419 ' HG3' ' HG3' ' A' ' 71' ' ' LYS . 45.3 mt-10 -119.56 107.33 13.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.939 0.4 . . . . 0.0 111.707 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.647 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -77.16 133.57 38.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.345 175.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.1 m -69.3 173.21 5.97 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -51.39 90.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.543 0.687 . . . . 0.0 112.727 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 15.04 60.74 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.767 0.667 . . . . 0.0 114.767 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 165.66 167.74 26.75 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 119.795 -1.193 . . . . 0.0 114.958 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.406 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 61.36 97.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.907 0.883 . . . . 0.0 113.332 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.647 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 8.7 ptp180 -86.92 103.13 15.01 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.237 0.542 . . . . 0.0 111.199 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -90.28 120.6 69.1 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.002 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 20.3 Cg_exo -66.31 96.99 0.35 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.677 2.251 . . . . 0.0 111.959 173.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -90.53 112.9 24.75 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.952 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -104.95 123.36 47.63 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.254 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -105.36 30.8 5.37 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.54 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.414 ' HG2' ' HB2' ' A' ' 69' ' ' ASP . 16.7 mmt85 -132.17 148.68 70.74 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 122.35 0.26 . . . . 0.0 111.554 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.85 123.25 7.82 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.562 2.175 . . . . 0.0 112.283 174.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 tp -90.55 108.53 19.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.008 0.432 . . . . 0.0 111.537 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.548 HD13 ' HB2' ' A' ' 21' ' ' ARG . 4.1 mm? -69.26 142.34 54.17 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.74 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.53 HG22 ' CH2' ' A' ' 13' ' ' TRP . 4.4 p -57.08 -30.98 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.438 0.637 . . . . 0.0 110.942 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.2 t -62.92 -28.08 69.81 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.286 178.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 10.0 mm-40 -87.13 -2.81 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.443 ' HA ' HG22 ' A' ' 61' ' ' VAL . 92.5 t -77.82 128.15 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 120.813 0.34 . . . . 0.0 111.412 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 28.7 m -70.5 -61.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.812 0.339 . . . . 0.0 111.377 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 95' ' ' ARG . 24.0 ttt85 -148.5 145.76 28.06 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.28 0.562 . . . . 0.0 111.924 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -111.2 105.58 14.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.874 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.517 ' HB1' ' HB3' ' A' ' 58' ' ' LEU . . . -87.67 90.25 8.3 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.941 -0.474 . . . . 0.0 111.837 -178.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -71.92 110.09 6.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.896 0.379 . . . . 0.0 111.004 177.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.9 mt -130.64 106.05 8.23 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -72.1 139.87 48.6 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 166.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.538 HD11 ' O ' ' A' ' 105' ' ' GLY . 83.7 mt -78.96 160.29 27.3 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -152.51 165.74 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 63.42 -84.95 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.484 0.713 . . . . 0.0 112.028 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -106.07 -22.63 12.83 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.873 0.844 . . . . 0.0 109.619 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.538 ' O ' HD11 ' A' ' 101' ' ' LEU . . . 120.25 15.05 5.22 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.296 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.558 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 39.8 t -137.32 75.13 46.69 Favored Pre-proline 0 CA--C 1.547 0.862 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -83.56 -73.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.482 2.121 . . . . 0.0 109.413 160.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.558 ' NE2' ' HA ' ' A' ' 106' ' ' VAL . 75.3 mt-30 56.07 -147.05 0.54 Allowed 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 161.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.462 HD12 ' N ' ' A' ' 109' ' ' LEU . 6.3 mp -64.78 5.65 0.3 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.97 -24.32 13.86 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.645 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -98.69 -28.61 13.45 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 120.993 0.425 . . . . 0.0 111.304 175.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -69.85 -36.77 75.81 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.446 ' HG ' ' HB3' ' A' ' 109' ' ' LEU . 52.8 mt . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 120.894 0.378 . . . . 0.0 111.719 -175.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.662 0.268 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.45 116.28 22.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.003 0.43 . . . . 0.0 111.526 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 17.4 pt -105.77 129.23 59.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.196 0.522 . . . . 0.0 110.55 173.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.488 ' HB3' HD12 ' A' ' 58' ' ' LEU . 6.6 m-85 -110.75 159.22 17.83 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -168.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HZ2' ' HB3' ' A' ' 6' ' ' LYS . 6.8 ttpm? -162.11 136.65 6.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.089 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -96.67 141.2 15.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.166 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -153.64 162.66 41.05 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.649 0.261 . . . . 0.0 110.812 174.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -73.69 149.34 41.97 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 19.5 mmm-85 -53.65 -40.44 65.86 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.319 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -23.9 59.95 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 111.831 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -89.32 -48.2 7.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 110.526 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 26.3 t-105 -65.17 -55.59 17.71 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.076 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -33.82 68.57 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.31 98.79 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.053 0.454 . . . . 0.0 110.617 173.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.66 93.85 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.414 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.523 ' HA ' HG22 ' A' ' 90' ' ' VAL . 52.6 mtmt -63.66 -38.3 90.61 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.514 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.26 -40.99 78.8 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.158 0.504 . . . . 0.0 111.139 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -95.89 1.01 52.73 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.826 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.53 5.03 41.85 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 114.22 0.448 . . . . 0.0 114.22 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.436 ' HG2' ' CD2' ' A' ' 89' ' ' LEU . 60.4 mtt85 -138.22 130.92 29.48 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.899 -0.765 . . . . 0.0 112.255 -175.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -95.25 111.38 23.24 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -102.81 -10.96 18.66 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -172.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.08 167.82 42.01 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.15 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.2 p -90.39 172.22 8.9 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 122.335 -0.509 . . . . 0.0 111.464 -177.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.37 -32.77 62.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.286 176.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.7 t -63.09 -45.06 99.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.069 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.491 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 7.7 m-20 -56.29 -51.45 68.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.906 0.384 . . . . 0.0 111.125 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.84 -35.48 80.1 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.997 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -35.36 72.2 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.136 0.494 . . . . 0.0 112.067 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.496 ' HB3' ' CE1' ' A' ' 35' ' ' HIS . 12.2 t70 -84.24 -55.65 4.07 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.397 -178.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.34 60.35 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 121.223 -0.513 . . . . 0.0 112.696 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.499 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 80.3 m-85 64.39 -171.91 0.18 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.508 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 65.8 mt -55.55 125.46 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -173.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.496 ' CE1' ' HB3' ' A' ' 31' ' ' ASP . 0.7 OUTLIER -87.68 146.59 25.63 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.823 178.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.543 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 5.1 mp -142.17 175.67 9.57 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.511 0.325 . . . . 0.0 110.156 167.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.5 m -140.52 159.55 41.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.043 0.449 . . . . 0.0 112.167 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.58 -174.35 3.81 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.531 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -51.36 -72.89 0.44 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.503 -0.379 . . . . 0.0 113.994 -177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -65.78 -32.45 73.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.027 0.442 . . . . 0.0 110.974 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -63.74 -29.51 70.71 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.03 -44.21 93.22 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.063 0.458 . . . . 0.0 110.917 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -66.71 -34.76 78.55 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.92 -52.08 66.58 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.101 0.477 . . . . 0.0 110.492 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 29.4 m -57.77 -38.96 76.36 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.017 0.437 . . . . 0.0 110.938 176.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.51 -50.07 68.83 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.882 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.04 -22.25 66.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -99.94 -43.23 6.46 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -109.78 -19.51 13.12 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -170.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.512 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 92.7 m-85 -131.81 28.48 4.54 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 122.021 -0.425 . . . . 0.0 112.041 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -71.62 119.12 15.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.849 0.357 . . . . 0.0 111.882 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.5 61.09 4.32 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-N 116.199 -0.455 . . . . 0.0 113.703 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.531 ' HB2' HD11 ' A' ' 56' ' ' LEU . 49.8 mt-30 -140.98 159.95 41.11 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 111.662 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.43 175.2 5.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.341 177.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 47.3 m-80 61.26 30.23 19.08 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.166 0.508 . . . . 0.0 111.172 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 53' ' ' GLN . 84.9 mt -92.96 127.23 38.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.39 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.51 122.54 60.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.815 0.34 . . . . 0.0 111.109 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.658 ' HB2' HD22 ' A' ' 99' ' ' LEU . 43.7 tp -88.1 98.09 11.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.849 0.357 . . . . 0.0 110.253 174.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 93.9 mt -74.18 107.27 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.823 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.49 100.74 10.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.627 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 95.9 t -109.08 131.62 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.038 0.447 . . . . 0.0 112.155 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -73.55 123.18 23.46 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.779 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.17 -52.2 64.78 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.543 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 1.8 mp0 -59.98 -48.75 93.92 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.543 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 38.1 Cg_exo -62.95 -16.11 52.01 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.153 1.902 . . . . 0.0 113.716 176.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tt -64.79 -65.83 0.62 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.0 -137.04 5.97 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.659 -0.781 . . . . 0.0 114.058 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -103.68 -21.63 13.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -172.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -78.86 30.49 0.2 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -169.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.439 HD11 ' HB3' ' A' ' 82' ' ' PRO . 58.6 tp -112.02 140.41 46.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.024 0.44 . . . . 0.0 111.748 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -150.86 128.12 11.27 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.358 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.568 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 76.6 m95 -76.98 86.05 3.5 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.416 0.626 . . . . 0.0 110.504 175.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.2 119.42 33.68 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.468 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.98 64.43 2.46 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.228 0.537 . . . . 0.0 110.89 176.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.9 p -77.74 74.15 4.3 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.07 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.438 HH11 ' HB2' ' A' ' 76' ' ' ARG . 3.1 mtm105 67.32 161.23 0.17 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.31 -63.36 3.97 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.19 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.63 150.09 5.2 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.193 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 68.06 -169.75 0.19 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.857 0.463 . . . . 0.0 111.791 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.568 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 4.4 mpt_? -104.86 122.67 46.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.241 0.543 . . . . 0.0 112.157 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -99.72 110.51 59.16 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.027 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.543 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 51.9 Cg_exo -55.89 111.43 0.77 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.668 2.245 . . . . 0.0 113.17 175.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -97.03 132.46 42.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.031 174.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.508 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 59.1 tp -107.91 111.7 23.94 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.937 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.14 30.04 0.28 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -173.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -160.35 154.13 19.19 Favored Pre-proline 0 N--CA 1.471 0.579 0 O-C-N 122.164 -0.335 . . . . 0.0 111.418 177.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.91 118.39 5.26 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.498 2.132 . . . . 0.0 112.331 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.6 tp -72.72 100.61 2.88 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.102 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.436 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 55.1 mt -58.9 130.06 45.16 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.506 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.523 HG22 ' HA ' ' A' ' 17' ' ' LYS . 96.0 t -56.54 -34.42 41.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 110.876 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.8 p -62.51 -26.75 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.88 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -87.11 -18.49 30.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -64.11 116.24 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.981 0.42 . . . . 0.0 111.254 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.627 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 51.0 p -70.99 -46.5 62.17 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -144.67 145.02 31.54 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -135.39 136.59 41.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.079 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.29 119.63 10.24 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.45 139.14 53.96 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.896 0.379 . . . . 0.0 110.808 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.658 HD22 ' HB2' ' A' ' 58' ' ' LEU . 3.5 mm? -89.02 105.9 18.08 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.54 90.64 6.79 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 168.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.712 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 70.9 mt -89.37 156.52 18.65 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -171.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -144.2 166.25 25.58 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.724 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 54.75 -86.41 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.498 0.719 . . . . 0.0 112.9 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -97.29 -7.36 32.28 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.441 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.712 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 69.63 43.73 66.74 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.609 -175.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.763 ' H ' ' HD2' ' A' ' 107' ' ' PRO . 71.4 t -156.08 -57.85 0.02 OUTLIER Pre-proline 0 N--CA 1.485 1.323 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.763 ' HD2' ' H ' ' A' ' 106' ' ' VAL . 7.4 Cg_endo -40.69 -74.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 124.462 3.442 . . . . 0.0 116.074 -164.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.579 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.3 OUTLIER -48.69 71.5 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -172.084 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 107' ' ' PRO . 1.3 tp -102.06 -31.06 10.81 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.777 -0.577 . . . . 0.0 111.842 170.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.21 -47.1 34.42 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.05 -26.76 68.99 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.837 0.351 . . . . 0.0 111.658 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -82.25 -28.59 31.76 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.907 0.384 . . . . 0.0 110.965 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 41.0 mt . . . . . 0 CA--C 1.535 0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.7 p . . . . . 0 N--CA 1.469 0.494 0 CA-C-O 120.829 0.347 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.485 HD22 ' HB3' ' A' ' 60' ' ' ALA . 2.3 tt -118.11 124.57 48.36 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 -173.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -96.58 148.33 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.008 0.433 . . . . 0.0 111.219 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.448 ' HB3' HD11 ' A' ' 58' ' ' LEU . 88.2 m-85 -126.79 103.15 7.37 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -172.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.777 ' HZ3' ' HB3' ' A' ' 8' ' ' LEU . 23.2 tptp -89.97 109.5 20.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.832 0.348 . . . . 0.0 111.208 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.1 mt -88.86 137.01 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.214 175.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.777 ' HB3' ' HZ3' ' A' ' 6' ' ' LYS . 1.7 pt? -166.11 171.13 12.71 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.992 0.425 . . . . 0.0 112.144 -177.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -80.95 148.12 29.96 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.74 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -58.13 -37.08 73.91 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.6 -21.94 65.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.758 0.313 . . . . 0.0 111.736 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -79.24 -51.71 9.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.532 0.682 . . . . 0.0 109.966 175.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.461 ' HB2' HD12 ' A' ' 8' ' ' LEU . 8.1 t-105 -64.01 -61.58 2.18 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.154 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.452 ' HA ' ' HB3' ' A' ' 17' ' ' LYS . 7.0 m-20 -60.69 -26.35 67.06 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.2 -44.45 83.87 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.127 0.489 . . . . 0.0 110.455 172.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.81 63.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.023 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.528 ' HA ' HG22 ' A' ' 90' ' ' VAL . 39.1 ttmt -66.02 -42.88 89.05 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.405 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.94 95.18 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.233 0.539 . . . . 0.0 110.753 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.91 -28.46 68.95 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.387 173.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.46 9.58 81.83 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.088 -171.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -150.93 112.25 4.38 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 122.609 -0.348 . . . . 0.0 111.673 -173.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.492 ' HB3' ' HB3' ' A' ' 88' ' ' LEU . 69.4 t80 -89.8 109.2 20.21 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.992 0.425 . . . . 0.0 110.688 175.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -93.97 -7.84 41.75 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.123 0.487 . . . . 0.0 111.129 -178.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.88 -177.7 19.39 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.922 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -104.63 -174.79 2.62 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 122.722 -0.281 . . . . 0.0 110.456 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.38 -43.79 61.99 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.98 0.419 . . . . 0.0 111.876 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.6 -40.85 82.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.865 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.61 -46.0 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.022 0.439 . . . . 0.0 110.919 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.51 -34.03 77.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.277 175.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.99 -44.02 97.61 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 111.027 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -69.48 -32.54 71.5 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.952 0.406 . . . . 0.0 111.136 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.31 -11.51 51.27 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.462 -0.399 . . . . 0.0 112.626 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -153.08 155.09 36.16 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.672 0.389 . . . . 0.0 110.731 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.0 mt -73.23 141.75 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.485 0.659 . . . . 0.0 112.233 -172.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -133.34 100.06 4.72 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.677 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.462 ' N ' HD13 ' A' ' 36' ' ' LEU . 4.8 mp -82.14 -32.74 29.93 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -171.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.2 m 73.22 165.14 0.29 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.885 0.474 . . . . 0.0 111.178 -174.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.37 131.26 20.32 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.08 -104.46 0.07 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 115.184 0.834 . . . . 0.0 115.184 171.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -48.59 -45.32 37.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.192 0.597 . . . . 0.0 111.67 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -68.33 -38.52 81.6 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.54 65.8 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.672 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.0 -39.19 94.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.87 -52.29 57.35 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.22 0.533 . . . . 0.0 110.593 177.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 m -58.68 -33.02 69.67 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.176 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.21 -48.55 81.0 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.778 0.323 . . . . 0.0 111.108 175.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -39.67 93.01 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.882 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -71.96 -43.79 64.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.994 0.426 . . . . 0.0 111.95 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -109.42 -66.05 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -172.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.403 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 98.8 m-85 -76.23 -8.1 56.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -163.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -63.31 2.16 0.42 Allowed 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -173.412 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -149.07 40.05 0.91 Allowed Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.403 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 1.6 mp0 -122.67 174.9 6.81 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.18 0.514 . . . . 0.0 111.67 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.26 161.49 17.14 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.276 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 59.8 36.8 22.12 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.206 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.2 mt -74.56 128.66 36.11 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.166 0.508 . . . . 0.0 111.904 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.2 t -121.86 145.83 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.892 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.448 HD11 ' HB3' ' A' ' 5' ' ' TYR . 47.2 tp -114.95 102.25 9.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.15 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 6' ' ' LYS . 90.4 mt -84.68 117.46 23.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.856 0.36 . . . . 0.0 111.414 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.485 ' HB3' HD22 ' A' ' 3' ' ' LEU . . . -102.88 115.83 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.116 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 50.2 t -126.08 137.32 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 111.657 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -77.83 130.99 37.35 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.753 0.311 . . . . 0.0 110.62 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.61 -28.37 28.53 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.574 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 7.0 mp0 -63.82 -46.99 82.1 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -174.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.574 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 7.8 Cg_endo -49.04 -66.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.532 2.155 . . . . 0.0 113.796 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.84 -26.97 67.73 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 58.81 -108.67 1.65 Allowed Glycine 0 CA--C 1.533 1.18 0 N-CA-C 115.104 0.802 . . . . 0.0 115.104 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.9 -27.74 66.97 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -170.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.423 ' HB3' ' HG2' ' A' ' 86' ' ' ARG . 79.0 m-20 -73.56 -7.16 50.77 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.1 tp -120.34 117.51 27.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.71 0.291 . . . . 0.0 110.245 174.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -133.45 134.05 43.08 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.14 0.495 . . . . 0.0 112.162 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -81.24 86.89 6.15 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.668 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -75.39 126.22 30.58 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.92 127.68 33.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.988 0.423 . . . . 0.0 111.358 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 87.3 p -74.11 176.64 6.37 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.396 0.617 . . . . 0.0 112.244 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -65.87 -30.05 70.59 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.972 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.96 14.27 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.779 176.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.55 -49.08 0.53 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.616 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.01 142.28 51.67 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -87.28 150.23 24.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.0 0.429 . . . . 0.0 111.728 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -130.48 124.74 21.25 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.268 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.98 99.5 0.4 Allowed 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.514 2.142 . . . . 0.0 112.357 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -98.25 125.13 43.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.447 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.1 tp -95.46 113.75 25.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.679 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -87.6 22.67 2.17 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.245 0.545 . . . . 0.0 111.824 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.423 ' HG2' ' HB3' ' A' ' 69' ' ' ASP . 31.3 mmt180 -131.97 140.6 38.67 Favored Pre-proline 0 N--CA 1.468 0.44 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.678 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -59.28 118.0 4.82 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 121.921 1.747 . . . . 0.0 110.987 170.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.492 ' HB3' ' HB3' ' A' ' 22' ' ' PHE . 56.4 tp -67.12 87.78 0.16 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.437 0.637 . . . . 0.0 111.578 -172.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.5 mt -60.22 134.18 56.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 17' ' ' LYS . 79.3 t -60.09 -31.77 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 121.201 0.524 . . . . 0.0 110.695 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.1 m -71.04 -11.94 61.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.481 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.6 -13.79 22.65 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.955 0.407 . . . . 0.0 111.141 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t -76.53 137.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.861 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.668 HG21 ' HG3' ' A' ' 95' ' ' ARG . 22.8 m -76.3 -66.3 0.82 Allowed 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.668 ' HG3' HG21 ' A' ' 94' ' ' THR . 62.1 mtt85 -141.92 152.79 43.87 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.17 125.35 47.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.045 0.45 . . . . 0.0 109.959 171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.42 155.73 30.24 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.3 0.571 . . . . 0.0 112.537 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -98.7 96.1 7.69 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 1.8 pt? -79.24 149.19 31.95 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.334 0.588 . . . . 0.0 112.26 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -86.53 174.35 9.0 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.844 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.695 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 75.1 mt -133.91 86.51 2.29 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.688 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.629 ' HB3' HE21 ' A' ' 108' ' ' GLN . 24.5 t70 -90.3 166.19 13.46 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -174.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.14 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -135.01 26.95 3.57 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.341 0.591 . . . . 0.0 110.44 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.695 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 102.36 22.34 9.87 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.71 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.8 t -98.02 112.65 62.37 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 122.495 -0.415 . . . . 0.0 110.844 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.39 121.94 10.7 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.674 2.249 . . . . 0.0 112.85 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.629 HE21 ' HB3' ' A' ' 102' ' ' ASP . 87.0 mm-40 -74.59 75.82 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.523 0.677 . . . . 0.0 111.645 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.604 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.9 mp -73.23 -16.08 61.41 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.946 177.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.95 -36.48 51.16 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.039 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -71.58 -22.58 61.71 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.969 0.414 . . . . 0.0 111.498 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -90.6 -14.38 32.55 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 18.2 mt . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.106 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.2 mt -125.49 144.82 50.37 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.416 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.605 HG21 HD11 ' A' ' 70' ' ' LEU . 17.5 pt -118.71 139.88 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-O 121.158 0.504 . . . . 0.0 111.694 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.426 ' HB3' HD23 ' A' ' 58' ' ' LEU . 20.5 m-85 -124.66 147.46 48.53 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.635 -177.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HZ3' HG21 ' A' ' 34' ' ' ILE . 87.8 tttt -143.7 119.6 10.62 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.794 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.0 mt -92.22 126.55 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 120.908 0.385 . . . . 0.0 110.884 175.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -143.37 168.19 20.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.598 -0.273 . . . . 0.0 110.979 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG3' ' A' ' 12' ' ' GLU . 29.0 t -71.25 145.34 49.65 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.977 0.418 . . . . 0.0 111.61 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.5 tpt85 -56.84 -31.28 64.6 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.965 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.25 -47.2 74.52 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.356 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 43.4 mt-10 -60.07 -42.19 94.03 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.233 0.54 . . . . 0.0 110.893 177.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.5 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 20.0 t-105 -70.22 -36.49 74.6 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.582 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.26 -52.02 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.611 0.72 . . . . 0.0 110.465 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.72 -36.56 79.15 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.521 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.408 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . . . -61.16 -46.89 88.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.957 0.408 . . . . 0.0 111.259 175.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.3 mttm -56.98 -41.56 78.6 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.632 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.9 -45.8 91.38 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.25 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -67.49 -26.44 66.36 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.037 0.446 . . . . 0.0 111.287 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.425 ' O ' HG23 ' A' ' 90' ' ' VAL . . . 87.35 -2.34 86.5 Favored Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.716 -170.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ptt-85 -160.37 168.6 24.87 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.8 0.334 . . . . 0.0 111.325 -176.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 16' ' ' ALA . 36.6 t80 -136.12 99.65 4.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.252 0.549 . . . . 0.0 110.111 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -94.44 172.89 7.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.091 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -74.97 140.25 26.4 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.688 -175.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.4 m -81.23 167.27 19.78 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 122.789 -0.242 . . . . 0.0 110.422 174.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.93 -32.65 46.76 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.878 0.37 . . . . 0.0 111.252 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.46 -51.31 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.222 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.09 -51.0 63.26 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.47 -32.38 64.92 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.743 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.27 -44.87 51.05 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.987 0.422 . . . . 0.0 111.59 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.97 -34.27 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.19 0.519 . . . . 0.0 111.21 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 138.9 52.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.929 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 65.46 -168.2 0.21 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 122.917 0.487 . . . . 0.0 111.491 -175.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.404 HG21 ' HZ3' ' A' ' 6' ' ' LYS . 57.5 mt -54.26 104.42 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 121.234 0.54 . . . . 0.0 112.117 -173.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -77.58 115.46 17.36 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.367 0.603 . . . . 0.0 111.757 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.509 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 65.1 mt -101.72 -170.27 1.8 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.814 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.8 p -141.31 156.2 45.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -94.63 -177.64 4.28 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.155 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.4 -78.77 0.1 OUTLIER Glycine 0 CA--C 1.53 1.03 0 N-CA-C 114.028 0.371 . . . . 0.0 114.028 -176.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -63.53 -28.48 69.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.202 -0.587 . . . . 0.0 111.651 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.87 -38.75 89.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.586 0.231 . . . . 0.0 111.562 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.25 -48.31 82.28 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.732 0.301 . . . . 0.0 110.948 175.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -59.55 -51.3 70.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.726 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.667 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 11.7 tp10 -62.58 -52.23 64.2 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.216 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 49.8 m -58.62 -38.07 77.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.878 0.37 . . . . 0.0 111.073 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -61.73 -44.61 96.59 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.823 0.344 . . . . 0.0 111.334 176.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.94 -25.6 64.64 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.667 ' HE2' ' HG3' ' A' ' 44' ' ' GLU . 54.5 mttm -88.44 -51.88 5.48 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -105.48 -43.02 5.06 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -169.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.511 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.1 m-85 -85.06 -2.07 57.57 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -174.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.8 ptt85 -62.36 130.96 47.63 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.087 0.47 . . . . 0.0 111.58 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.39 -7.83 80.53 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.267 -0.492 . . . . 0.0 113.457 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.419 ' HB2' HD11 ' A' ' 56' ' ' LEU . 70.4 mt-30 -91.36 116.75 29.09 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.229 -0.571 . . . . 0.0 111.022 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.66 155.76 19.41 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.897 0.38 . . . . 0.0 111.391 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 63.37 73.0 0.46 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.47 0.652 . . . . 0.0 111.435 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 53' ' ' GLN . 97.1 mt -120.76 154.3 35.85 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.804 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.1 t -128.78 138.74 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.939 0.4 . . . . 0.0 111.257 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.426 HD23 ' HB3' ' A' ' 5' ' ' TYR . 5.9 tt -112.95 108.69 17.71 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.973 0.416 . . . . 0.0 109.941 176.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.15 110.98 17.17 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.205 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.83 117.38 34.22 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.51 130.88 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 120.96 0.409 . . . . 0.0 111.667 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.17 108.52 14.89 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.053 0.454 . . . . 0.0 110.848 176.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.83 52.94 2.61 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -169.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.49 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 44.5 mt-10 -80.92 -58.32 0.53 Allowed Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.914 -0.491 . . . . 0.0 111.975 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.49 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 83.1 Cg_endo -76.68 -38.72 0.86 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 122.07 1.847 . . . . 0.0 113.338 -178.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -98.57 21.66 10.95 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.185 0.517 . . . . 0.0 111.561 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.52 -11.14 40.11 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 115.0 0.76 . . . . 0.0 115.0 -174.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -121.5 4.69 10.16 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 117.753 0.777 . . . . 0.0 111.49 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.558 ' HB3' ' HD3' ' A' ' 86' ' ' ARG . 2.3 m-20 -80.45 -1.94 43.67 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 111.008 175.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.605 HD11 HG21 ' A' ' 4' ' ' ILE . 2.7 pt? -137.07 163.83 29.85 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.026 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -123.79 126.22 46.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.997 0.427 . . . . 0.0 111.92 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -80.29 82.73 6.28 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.174 0.512 . . . . 0.0 110.315 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -77.94 98.24 5.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.328 0.585 . . . . 0.0 112.178 -175.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -92.16 67.72 5.05 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.546 0.689 . . . . 0.0 110.006 172.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 79.8 p -129.37 -73.13 0.57 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.612 -176.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -70.27 102.38 2.11 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.773 0.32 . . . . 0.0 111.191 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.91 -19.4 41.16 Favored Glycine 0 CA--C 1.525 0.698 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.046 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.65 -33.74 4.85 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 121.279 -0.486 . . . . 0.0 113.987 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -77.72 169.46 18.26 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.113 0.483 . . . . 0.0 112.015 -178.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -83.28 110.19 17.89 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -115.26 105.71 52.12 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.509 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 44.7 Cg_endo -71.76 114.26 3.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.564 2.176 . . . . 0.0 112.694 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -108.74 118.6 37.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.879 175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.94 116.07 28.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.069 0.462 . . . . 0.0 110.43 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -87.14 9.32 20.31 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.023 0.44 . . . . 0.0 111.771 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.558 ' HD3' ' HB3' ' A' ' 69' ' ' ASP . 35.1 mtp85 -129.52 149.41 72.79 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.065 -176.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.62 132.14 28.04 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.635 2.224 . . . . 0.0 112.701 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.418 HD22 HG23 ' A' ' 93' ' ' VAL . 10.1 tt -89.6 106.32 18.38 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.9 mt -74.46 138.55 43.31 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.256 -0.277 . . . . 0.0 110.369 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 20' ' ' GLY . 26.2 m -61.19 -31.46 50.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.862 -0.524 . . . . 0.0 111.763 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 84.9 p -67.47 -12.28 59.92 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.67 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -90.65 -21.57 21.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.578 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.418 HG23 HD22 ' A' ' 88' ' ' LEU . 48.7 t -62.21 118.15 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.694 0.283 . . . . 0.0 111.687 -176.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.434 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 87.8 m -58.45 -56.38 22.9 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.017 0.437 . . . . 0.0 111.125 177.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -145.0 144.63 31.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.219 0.533 . . . . 0.0 111.483 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -116.5 103.53 10.51 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.39 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -91.03 107.39 19.17 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.761 0.315 . . . . 0.0 111.827 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.65 111.35 4.74 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.08 119.33 9.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.471 0.653 . . . . 0.0 112.43 -173.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -71.73 -42.17 67.62 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.614 -176.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.4 mt 68.27 132.79 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.246 0.618 . . . . 0.0 111.836 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -140.09 162.29 35.59 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.272 0.558 . . . . 0.0 111.896 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.19 -79.82 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -105.21 11.97 32.44 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -171.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 71.89 30.08 66.3 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.026 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.78 142.3 26.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.123 0.569 . . . . 0.0 109.999 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.487 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 13.0 Cg_exo -71.99 103.72 1.53 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 122.13 1.887 . . . . 0.0 112.68 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -80.88 80.83 7.28 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.16 0.505 . . . . 0.0 111.643 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.9 mp -66.11 -26.67 67.56 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 122.048 -0.408 . . . . 0.0 110.864 174.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.28 -23.05 46.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.338 -0.458 . . . . 0.0 113.333 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -98.76 -11.73 21.61 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 122.463 -0.433 . . . . 0.0 111.584 175.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -88.8 -37.95 15.02 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.808 0.337 . . . . 0.0 111.502 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 14.0 mt . . . . . 0 CA--C 1.541 0.62 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.301 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.97 123.54 46.06 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.864 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.424 HD13 HD12 ' A' ' 36' ' ' LEU . 13.1 pt -108.71 153.75 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -177.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.431 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 94.9 m-85 -131.85 163.11 28.99 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.583 0.706 . . . . 0.0 112.536 -176.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.61 ' HZ3' ' HB2' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -157.95 115.56 3.0 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 177.198 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.5 mt -102.38 127.43 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.613 0.244 . . . . 0.0 111.339 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.44 ' N ' HD21 ' A' ' 8' ' ' LEU . 2.2 pt? -151.92 166.0 32.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.916 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 m -69.46 146.71 51.74 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 122.3 -0.25 . . . . 0.0 111.67 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -57.25 -52.2 66.3 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.46 -39.76 64.73 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.162 0.506 . . . . 0.0 111.409 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -67.11 -36.33 81.69 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.847 177.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -64.28 -48.49 75.48 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.221 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.28 -30.22 69.32 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.53 0.205 . . . . 0.0 111.375 176.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.05 -60.19 3.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.989 0.423 . . . . 0.0 110.882 174.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.21 -35.22 69.37 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 111.266 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.558 ' HA ' HG22 ' A' ' 90' ' ' VAL . 26.5 ttpp -69.92 -31.87 69.87 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.395 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.87 -21.7 61.62 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.303 0.573 . . . . 0.0 111.037 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -87.74 -23.13 24.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.971 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.95 -2.74 63.64 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 121.275 -0.488 . . . . 0.0 112.117 -172.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.56 ' HG3' HD23 ' A' ' 89' ' ' LEU . 54.0 ttp180 -143.13 141.53 31.23 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.006 0.431 . . . . 0.0 111.663 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -110.16 109.67 20.27 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.627 176.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -122.56 90.33 3.28 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.615 0.721 . . . . 0.0 112.226 179.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.98 101.62 0.02 OUTLIER Glycine 0 CA--C 1.533 1.194 0 N-CA-C 115.671 1.028 . . . . 0.0 115.671 171.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.2 m -76.75 177.9 7.22 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 167.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.06 -46.45 33.5 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.112 0.482 . . . . 0.0 112.294 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.0 t -70.06 -44.59 78.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.739 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.35 -27.5 69.06 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.87 0.367 . . . . 0.0 111.481 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.48 -36.3 73.77 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.312 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.16 -49.0 77.6 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.741 172.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.04 -28.17 69.4 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.623 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.82 -45.96 3.09 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -175.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -116.68 145.26 43.56 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -52.8 114.67 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -176.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -90.45 107.96 19.48 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.813 0.816 . . . . 0.0 110.532 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.586 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 35.0 mt -89.45 54.88 3.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.522 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -45.87 107.12 0.09 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.897 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -103.31 147.05 27.56 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.6 -113.43 3.08 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 115.541 -0.754 . . . . 0.0 114.667 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -54.89 -47.67 74.02 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -59.81 -39.97 86.84 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.757 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.36 -56.55 19.09 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.939 0.399 . . . . 0.0 111.445 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -61.74 -49.7 75.36 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.8 -22.38 66.98 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -176.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.0 m -81.0 -40.5 24.22 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.21 0.529 . . . . 0.0 110.311 171.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.57 74.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.278 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.403 ' O ' ' HD3' ' A' ' 51' ' ' ARG . . . -62.58 -24.57 67.62 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -100.31 -56.54 2.33 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.129 0.49 . . . . 0.0 111.971 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -78.6 -37.72 41.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -109.25 8.85 25.9 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -172.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 47' ' ' ALA . 13.5 ptt180 -61.25 136.62 58.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.979 0.419 . . . . 0.0 111.654 178.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.66 -26.02 16.14 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.404 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -85.82 116.23 23.95 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 122.534 -0.392 . . . . 0.0 111.424 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.471 ' HB1' ' HA ' ' A' ' 100' ' ' ASP . . . -103.89 -0.46 29.05 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -92.03 15.78 12.59 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.65 159.08 18.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -177.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.7 143.34 38.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.988 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.0 tt -98.68 133.57 42.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.796 0.331 . . . . 0.0 110.967 175.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.4 mt -104.94 130.01 53.21 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.322 0.249 . . . . 0.0 110.975 177.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -118.84 122.19 41.78 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.721 0.296 . . . . 0.0 110.915 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.2 t -133.84 137.88 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.735 0.302 . . . . 0.0 111.562 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -77.19 127.65 32.99 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 170.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -52.36 64.12 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -175.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.462 ' HG3' ' HD2' ' A' ' 65' ' ' PRO . 35.0 tt0 69.43 141.52 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.921 0 C-N-CA 122.885 0.474 . . . . 0.0 110.874 -173.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.462 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 24.4 Cg_endo -61.59 77.45 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.575 2.184 . . . . 0.0 112.65 177.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.4 mt -72.64 -59.38 2.75 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.661 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.78 -118.71 0.79 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.365 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -130.38 18.26 5.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 122.381 -0.482 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -79.37 -36.6 39.04 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.83 0.348 . . . . 0.0 111.554 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -81.55 101.82 10.21 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.254 0.549 . . . . 0.0 110.804 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HD3' ' CE1' ' A' ' 85' ' ' TYR . 48.9 mtpt -95.67 109.87 22.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.136 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.517 ' CZ3' ' HG3' ' A' ' 82' ' ' PRO . 78.1 m95 -74.25 73.38 1.8 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.717 0.77 . . . . 0.0 109.256 167.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -90.15 117.5 28.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.246 -169.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -86.71 132.8 33.77 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 176.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.2 t -145.52 178.89 7.79 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 62.97 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.903 0.481 . . . . 0.0 111.7 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.32 23.65 0.44 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.38 -158.64 26.98 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.982 -0.447 . . . . 0.0 111.982 -176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 62.87 111.42 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.253 0.549 . . . . 0.0 112.371 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 -82.16 93.4 7.05 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.938 0.399 . . . . 0.0 111.63 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -78.86 113.98 39.99 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.515 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.586 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 12.3 Cg_exo -69.61 88.31 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.464 2.109 . . . . 0.0 112.494 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -88.52 106.49 18.32 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.5 tp -92.05 122.65 34.75 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.05 0.453 . . . . 0.0 111.229 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.502 ' CE1' ' HD3' ' A' ' 71' ' ' LYS . 2.0 m-85 -86.43 21.18 2.18 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -132.6 143.15 47.55 Favored Pre-proline 0 N--CA 1.473 0.709 0 O-C-N 122.048 -0.408 . . . . 0.0 111.278 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.87 111.12 1.85 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.299 1.999 . . . . 0.0 111.447 172.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.45 114.12 10.23 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.802 -170.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.56 HD23 ' HG3' ' A' ' 21' ' ' ARG . 71.0 mt -73.26 142.28 47.24 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.745 0.307 . . . . 0.0 111.155 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.558 HG22 ' HA ' ' A' ' 17' ' ' LYS . 86.1 t -59.08 -31.39 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.304 0.573 . . . . 0.0 111.06 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.6 p -73.79 -10.83 60.08 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.17 176.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.496 ' HG3' ' HB2' ' A' ' 89' ' ' LEU . 55.3 mt-10 -89.22 -18.31 27.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.852 0.358 . . . . 0.0 110.556 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.1 t -72.52 127.45 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.409 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 89.0 m -73.33 -65.22 0.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.1 ptt-85 -148.18 154.56 40.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.812 0.339 . . . . 0.0 111.767 -174.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.62 174.19 5.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.043 0.449 . . . . 0.0 110.768 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.426 ' HB2' ' CE1' ' A' ' 112' ' ' HIS . . . -152.72 98.17 2.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.808 0.337 . . . . 0.0 111.601 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.08 136.56 39.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.511 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.494 HD21 ' N ' ' A' ' 99' ' ' LEU . 1.5 pt? -141.06 97.52 3.19 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.635 0.731 . . . . 0.0 112.172 -177.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.471 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t70 -84.64 127.93 34.34 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.498 173.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.28 -171.54 3.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.05 0.452 . . . . 0.0 111.932 -171.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -142.48 -168.07 2.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.755 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.18 -0.73 15.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -175.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -133.56 -31.79 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -54.25 -53.41 37.9 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 110.531 -1.027 . . . . 0.0 110.531 164.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.507 HG13 ' HD2' ' A' ' 107' ' ' PRO . 2.1 t 65.68 146.04 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 170.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.507 ' HD2' HG13 ' A' ' 106' ' ' VAL . 24.1 Cg_exo -33.31 99.37 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.25 0 C-N-CA 123.756 2.97 . . . . 0.0 114.613 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -76.26 78.66 3.04 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.609 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.5 mp -100.19 -16.89 17.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.3 -27.96 48.65 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.246 -0.502 . . . . 0.0 113.921 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.95 -9.79 33.01 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 82.3 m-70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 23.2 mt . . . . . 0 CA--C 1.538 0.49 0 CA-C-O 121.017 0.437 . . . . 0.0 111.38 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.78 0.324 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 89.2 mt -115.64 122.54 45.91 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.878 0.37 . . . . 0.0 110.817 177.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.496 HD13 HD12 ' A' ' 36' ' ' LEU . 23.6 pt -102.51 149.38 7.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.033 0.444 . . . . 0.0 111.458 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.435 ' HB3' HD12 ' A' ' 58' ' ' LEU . 80.3 m-85 -142.65 121.67 12.85 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.772 -174.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' NZ ' HG21 ' A' ' 34' ' ' ILE . 79.6 tttt -110.48 125.29 53.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.921 0.391 . . . . 0.0 110.896 176.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.431 HD11 HD22 ' A' ' 109' ' ' LEU . 65.9 mt -98.29 132.49 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.342 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -145.78 171.06 15.33 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.687 178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.4 p -77.85 148.92 34.43 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.127 0.489 . . . . 0.0 111.324 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -56.72 -36.1 69.31 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.5 -49.03 75.9 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.3 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -70.0 -40.85 75.03 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.503 ' HZ2' ' HG2' ' A' ' 96' ' ' GLU . 41.3 t-105 -63.4 -40.01 96.06 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.492 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 4.7 t0 -62.93 -43.84 97.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.246 0.546 . . . . 0.0 110.039 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.08 -46.08 85.86 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.513 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.62 89.49 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.208 0.527 . . . . 0.0 111.07 175.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.492 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 25.5 ttpp -60.75 -44.14 97.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.984 175.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -38.4 89.89 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.196 0.522 . . . . 0.0 111.352 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.39 -29.13 61.41 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.442 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.1 5.05 89.11 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.736 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 23' ' ' GLU . 57.2 mtp180 -146.28 134.9 22.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.791 0.436 . . . . 0.0 111.278 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -102.11 98.44 8.61 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.449 0.643 . . . . 0.0 110.008 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 21' ' ' ARG . 34.8 mm-40 -80.49 -176.05 5.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.23 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.12 116.81 8.86 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.176 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.4 p -74.21 -174.17 1.87 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.498 -0.413 . . . . 0.0 110.681 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.74 -37.21 65.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.01 0.433 . . . . 0.0 111.12 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.3 t -77.94 -47.22 25.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.11 0.481 . . . . 0.0 111.705 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.65 -43.1 99.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.174 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.63 -28.63 62.87 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.88 73.03 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.046 0.45 . . . . 0.0 110.909 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.51 -31.11 53.28 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.375 173.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.16 -12.45 48.59 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.365 -0.379 . . . . 0.0 112.531 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -141.55 151.51 43.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.997 0.519 . . . . 0.0 111.01 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.412 HG21 ' NZ ' ' A' ' 6' ' ' LYS . 55.1 mt -69.85 135.27 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -171.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -87.2 145.95 26.2 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.899 173.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD11 HD13 ' A' ' 84' ' ' LEU . 78.5 mt -134.64 -69.76 0.51 Allowed 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.535 ' OG ' ' HB2' ' A' ' 41' ' ' GLN . 39.9 t 76.89 165.25 0.25 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.484 0.714 . . . . 0.0 112.343 -175.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' ILE . . . -111.05 176.63 4.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.532 176.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.27 -44.19 7.68 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.441 0.536 . . . . 0.0 114.441 -177.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.06 -66.27 0.41 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.008 0.432 . . . . 0.0 111.929 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.535 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 20.8 mt-30 -76.11 -15.61 60.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -176.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.96 64.88 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.777 0.322 . . . . 0.0 110.686 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.551 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 13.3 tt0 -66.74 -35.73 80.8 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.217 175.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.628 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 63.7 mm-40 -55.21 -60.94 2.69 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.998 0.428 . . . . 0.0 110.724 173.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -54.71 -40.13 68.91 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.449 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.467 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -61.71 -41.04 97.08 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.466 176.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.85 -37.56 64.76 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.628 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 48.8 mttm -78.98 -61.52 1.99 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.02 0.438 . . . . 0.0 111.9 -178.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.55 -40.67 16.04 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -107.57 35.39 3.1 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 122.303 -0.248 . . . . 0.0 111.617 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -24.01 -51.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.711 1.204 . . . . 0.0 113.955 -174.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.53 50.14 0.46 Allowed Glycine 0 CA--C 1.525 0.695 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.731 177.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.526 ' HB2' HD22 ' A' ' 56' ' ' LEU . 77.6 mm-40 -77.46 124.74 28.3 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.544 -0.386 . . . . 0.0 111.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.46 68.25 4.85 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.128 0.489 . . . . 0.0 112.095 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -175.39 22.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.303 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.526 HD22 ' HB2' ' A' ' 53' ' ' GLN . 42.1 mt -84.21 141.02 31.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.396 0.617 . . . . 0.0 112.288 -173.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.1 t -123.47 128.59 74.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.381 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.435 HD12 ' HB3' ' A' ' 5' ' ' TYR . 52.7 tp -95.82 114.03 25.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.299 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.2 mt -91.56 105.8 18.01 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.805 0.336 . . . . 0.0 110.96 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.69 112.73 24.66 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.479 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 93' ' ' VAL . 20.7 t -130.59 137.36 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.949 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.83 133.74 39.26 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 173.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.37 -74.09 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 59.18 161.52 0.09 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -59.73 -62.13 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.119 1.879 . . . . 0.0 112.182 169.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.3 pp 34.61 33.71 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.98 121.42 4.91 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.849 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.83 -1.12 0.56 Allowed 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -61.02 -25.43 66.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.761 0.315 . . . . 0.0 111.329 174.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.79 106.14 16.81 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.911 0.386 . . . . 0.0 110.295 174.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HE2' ' HG2' ' A' ' 73' ' ' GLU . 78.3 tttt -125.86 128.39 47.55 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -174.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 75.0 m95 -79.38 105.6 10.81 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.213 -0.304 . . . . 0.0 111.238 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.431 ' HG2' ' HE2' ' A' ' 71' ' ' LYS . 44.3 mt-10 -118.46 131.08 56.27 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 111.784 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -94.26 115.68 27.96 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.2 t -75.89 173.61 10.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.24 0.543 . . . . 0.0 112.168 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -64.94 98.03 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.476 0.655 . . . . 0.0 111.599 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 147.49 -33.13 1.33 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.134 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.23 -28.23 3.67 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.45 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -57.73 123.98 17.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 68.4 mtm180 -97.6 96.85 8.57 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.279 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.403 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 68.3 m-85 -104.95 112.81 65.26 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.512 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 27.9 Cg_endo -64.16 108.3 0.94 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.079 1.853 . . . . 0.0 111.748 173.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -90.47 126.15 35.81 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.348 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.588 HD13 HD11 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -96.45 112.69 24.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.419 178.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -78.69 3.29 16.87 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 120.794 0.331 . . . . 0.0 111.616 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.412 ' HB3' HD23 ' A' ' 84' ' ' LEU . 7.1 tpp180 -119.29 140.1 28.54 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 122.929 0.492 . . . . 0.0 110.635 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -53.19 139.08 63.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.45 2.1 . . . . 0.0 112.484 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 tt -88.81 107.11 18.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.188 0.518 . . . . 0.0 111.049 -173.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.521 ' HB2' ' HG2' ' A' ' 92' ' ' GLU . 50.8 mt -79.35 130.79 35.78 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.54 -22.88 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 O-C-N 121.845 -0.534 . . . . 0.0 111.808 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 58.6 m -66.97 -15.97 64.05 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.532 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.521 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 51.4 mm-40 -81.51 -18.32 45.51 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.522 ' HA ' HG22 ' A' ' 61' ' ' VAL . 59.6 t -70.87 117.96 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 120.961 0.41 . . . . 0.0 111.879 -176.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.5 m -60.8 -46.95 88.5 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.966 0.413 . . . . 0.0 111.33 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -159.19 148.52 18.57 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.748 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.503 ' HG2' ' HZ2' ' A' ' 13' ' ' TRP . 0.4 OUTLIER -134.02 154.84 50.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.657 0.265 . . . . 0.0 111.14 177.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -166.82 150.05 6.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.878 0.37 . . . . 0.0 111.737 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -66.27 123.73 20.75 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.518 HD22 HD12 ' A' ' 109' ' ' LEU . 54.2 tp -78.31 128.55 33.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.585 -174.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -92.26 156.34 17.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.971 0.415 . . . . 0.0 111.306 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 73.7 mt -100.31 174.69 6.01 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.241 0.543 . . . . 0.0 112.016 -175.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.45 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 31.4 t70 -100.95 173.27 6.56 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.346 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.07 -33.16 37.97 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.948 0.404 . . . . 0.0 111.601 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.83 -28.98 24.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.254 0.549 . . . . 0.0 110.633 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.04 -23.78 6.46 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.605 -174.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.3 t -59.24 119.21 36.93 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.467 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 33.9 Cg_exo -59.19 111.32 0.88 Allowed 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 122.538 2.159 . . . . 0.0 112.817 177.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.45 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 85.2 mm-40 -88.79 84.86 6.68 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.299 0.571 . . . . 0.0 112.355 -175.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.551 ' HB2' ' HB2' ' A' ' 43' ' ' GLN . 7.5 mp -81.94 -35.64 28.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.495 177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.76 -34.73 29.62 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.949 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.47 -33.38 21.87 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.876 0.369 . . . . 0.0 111.415 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.65 -27.13 65.72 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 48.9 mt . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 121.196 0.522 . . . . 0.0 112.108 -175.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.498 ' HB ' ' HB1' ' A' ' 63' ' ' ALA . 61.6 m . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 121.099 0.476 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -76.75 111.83 12.69 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.9 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.429 HD13 HD11 ' A' ' 36' ' ' LEU . 6.9 pt -96.32 135.14 31.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.08 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 71.7 m-85 -116.09 155.96 27.24 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -172.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.467 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 63.0 tttp -154.82 129.65 9.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.627 174.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.55 120.62 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 120.605 0.241 . . . . 0.0 110.931 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.49 158.48 44.26 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.838 0.351 . . . . 0.0 111.237 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 p -69.92 151.36 45.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.211 0.529 . . . . 0.0 112.088 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -58.81 -60.69 3.44 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.54 -33.79 64.12 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -69.41 -38.82 78.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.897 0.379 . . . . 0.0 111.088 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 44.1 t-105 -64.67 -46.48 82.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.812 0.339 . . . . 0.0 110.77 174.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.6 -37.06 84.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 176.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -61.76 -53.63 53.43 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.968 0.413 . . . . 0.0 110.828 175.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.32 -37.64 78.28 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.162 0.506 . . . . 0.0 111.311 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.541 ' HA ' HG22 ' A' ' 90' ' ' VAL . 25.7 ttpp -67.42 -33.74 75.8 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.05 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.04 -36.43 79.91 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.267 0.556 . . . . 0.0 110.676 173.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 76.2 mm-40 -74.36 -29.45 61.57 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.0 175.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.79 2.97 74.62 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 115.993 -0.548 . . . . 0.0 112.587 -175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -154.19 129.0 9.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 111.62 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.467 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 65.1 t80 -95.92 97.9 9.99 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.172 0.51 . . . . 0.0 110.204 173.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.25 -36.67 71.85 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.132 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.44 157.7 7.66 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.533 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -84.47 170.05 13.89 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.396 0.279 . . . . 0.0 110.916 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.86 -43.8 69.84 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.074 0.464 . . . . 0.0 111.405 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.9 t -61.82 -32.37 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.503 176.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 71.1 m-20 -72.89 -49.89 27.05 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.943 0.401 . . . . 0.0 111.226 179.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.43 -34.69 78.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.809 0.337 . . . . 0.0 111.618 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.52 78.6 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.083 0.468 . . . . 0.0 111.485 176.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.74 -38.93 37.65 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.008 0.432 . . . . 0.0 111.53 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.86 -20.55 28.98 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.887 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -129.59 160.23 33.91 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.685 0.394 . . . . 0.0 110.48 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.54 ' O ' HG22 ' A' ' 34' ' ' ILE . 32.7 mt -75.86 12.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.4 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 32.0 m-70 49.59 88.74 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.654 -0.654 . . . . 0.0 112.356 -178.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 73.0 mt -117.45 155.88 28.93 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 122.156 -0.34 . . . . 0.0 110.628 176.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -141.9 149.03 39.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.67 -179.9 4.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.143 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -48.3 -63.3 3.76 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 121.463 -0.399 . . . . 0.0 114.054 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -55.6 -50.03 71.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.248 0.546 . . . . 0.0 111.674 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -60.89 -33.42 73.08 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.862 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.76 -44.74 66.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.012 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.48 -35.79 81.93 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.181 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.14 -56.87 11.78 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.895 0.378 . . . . 0.0 110.296 174.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 97.0 m -55.02 -31.62 61.2 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.274 176.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.83 -58.73 4.94 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.899 0.38 . . . . 0.0 111.176 175.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.81 69.01 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -87.54 -45.62 10.3 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -112.39 -52.11 2.8 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.555 ' HB3' HE22 ' A' ' 53' ' ' GLN . 97.1 m-85 -102.45 60.18 0.82 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.677 0.751 . . . . 0.0 111.521 -170.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -106.4 3.37 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.432 ' HA2' HD12 ' A' ' 101' ' ' LEU . . . -113.9 60.06 0.38 Allowed Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.916 171.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.555 HE22 ' HB3' ' A' ' 50' ' ' PHE . 6.8 mm-40 -73.69 110.07 7.7 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.9 -66.82 1.02 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -137.1 61.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.549 0.69 . . . . 0.0 110.902 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.19 -179.96 5.54 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.171 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.9 t -134.86 147.37 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.98 0.419 . . . . 0.0 111.675 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 70.2 tp -101.32 108.88 20.63 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.657 174.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.8 mt -84.75 147.84 26.66 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.887 0.375 . . . . 0.0 111.701 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.516 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -141.39 131.48 24.73 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 176.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.7 t -136.59 141.7 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -74.44 120.49 20.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.723 0.409 . . . . 0.0 111.15 173.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.498 ' HB1' ' HB ' ' A' ' 2' ' ' THR . . . -77.61 -35.09 53.15 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -56.91 -55.28 45.33 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -173.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.43 0.11 9.46 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.141 1.894 . . . . 0.0 114.301 -170.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.28 -49.82 68.07 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 122.14 -0.35 . . . . 0.0 111.72 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.3 42.01 0.48 Allowed Glycine 0 CA--C 1.525 0.697 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.701 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 55.65 20.41 3.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.522 ' HB3' ' HG3' ' A' ' 86' ' ' ARG . 8.8 m-20 -70.7 -16.07 62.76 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.983 0.42 . . . . 0.0 111.85 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 82' ' ' PRO . 39.4 tp -90.21 112.0 23.36 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.887 0.375 . . . . 0.0 110.929 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.544 ' HD2' ' HB2' ' A' ' 73' ' ' GLU . 3.7 tmtp? -95.61 104.27 16.18 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.862 0.363 . . . . 0.0 110.904 -178.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -69.55 94.33 0.75 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 110.022 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.544 ' HB2' ' HD2' ' A' ' 71' ' ' LYS . 11.7 tp10 -122.27 138.39 54.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.773 -169.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.442 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -83.32 176.47 9.1 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.37 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.1 t -168.42 -171.58 1.5 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.161 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.7 mtp85 -54.07 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 111.467 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 144.36 -16.98 2.08 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.489 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.22 -4.17 77.9 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.902 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -95.6 129.44 42.8 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.387 -0.478 . . . . 0.0 111.936 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.442 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 87.5 mtt180 -80.29 109.46 14.79 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.978 0.418 . . . . 0.0 111.3 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -98.58 139.06 20.87 Favored Pre-proline 0 C--O 1.239 0.528 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 176.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.527 ' HB2' HD11 ' A' ' 70' ' ' LEU . 28.8 Cg_endo -63.24 97.22 0.19 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.279 1.986 . . . . 0.0 112.126 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -91.14 104.94 17.45 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.053 0.454 . . . . 0.0 111.995 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.3 tp -97.46 122.5 40.58 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.726 175.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -106.26 16.88 24.26 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.209 0.528 . . . . 0.0 111.424 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HG3' ' HB3' ' A' ' 69' ' ' ASP . 18.7 mmm180 -112.03 130.78 22.91 Favored Pre-proline 0 N--CA 1.47 0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.83 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.29 116.32 2.88 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.658 2.239 . . . . 0.0 112.709 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 50.0 tp -74.13 95.26 2.54 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 121.072 0.463 . . . . 0.0 111.622 -175.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.3 mt -59.67 122.9 15.27 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.541 HG22 ' HA ' ' A' ' 17' ' ' LYS . 83.0 t -61.58 -34.1 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.875 0.369 . . . . 0.0 111.966 -176.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -72.74 0.32 11.15 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -118.56 -1.15 11.23 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.866 0.365 . . . . 0.0 111.302 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 79.8 t -74.3 139.26 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 122.183 -0.323 . . . . 0.0 111.539 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 37.0 m -69.36 -59.44 2.99 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 95' ' ' ARG . 1.9 mmp_? -147.07 151.1 36.33 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 8.0 pt-20 -129.92 95.91 4.07 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.891 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.56 132.07 44.27 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.99 149.92 41.02 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.68 171.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.507 HD23 ' N ' ' A' ' 99' ' ' LEU . 1.9 pt? -150.85 146.22 26.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.094 0.473 . . . . 0.0 112.091 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -127.71 -161.49 1.09 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.81 177.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.432 HD12 ' HA2' ' A' ' 52' ' ' GLY . 98.1 mt -117.22 135.74 53.57 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -143.72 -175.55 4.62 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.665 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.83 -78.19 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 177.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -139.13 17.92 2.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.651 0.739 . . . . 0.0 110.223 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 100.2 32.47 5.53 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.093 -173.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.6 t -116.95 132.2 23.56 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 122.52 0.328 . . . . 0.0 110.665 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -79.17 77.3 4.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.865 1.71 . . . . 0.0 111.163 171.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.07 83.72 0.51 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 122.733 1.254 . . . . 0.0 111.577 -174.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 6.39 0.27 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.256 -1.338 . . . . 0.0 113.216 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.32 -25.97 4.61 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.431 -0.414 . . . . 0.0 113.644 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.5 -36.65 84.87 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.596 0.713 . . . . 0.0 110.658 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -76.7 -23.91 53.12 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.335 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.8 mt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 120.917 0.389 . . . . 0.0 111.76 -174.099 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.2 mt -125.66 150.99 47.14 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.5 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.682 HG13 HD11 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -125.02 149.8 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 120.726 0.298 . . . . 0.0 110.757 174.179 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -130.9 141.46 50.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 35' ' ' HIS . 24.9 ttmm -134.91 127.45 30.66 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.999 173.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.52 ' N ' HD13 ' A' ' 7' ' ' ILE . 3.4 mp -101.3 130.74 50.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.436 ' N ' HD21 ' A' ' 8' ' ' LEU . 2.2 pt? -154.94 166.27 34.08 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.789 177.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 57.4 p -78.46 143.15 36.95 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 122.185 -0.322 . . . . 0.0 110.381 178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.533 ' HA ' ' HB3' ' A' ' 13' ' ' TRP . 79.7 ttt180 -60.97 -25.2 66.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.0 -32.15 67.64 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.03 0.443 . . . . 0.0 111.288 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -89.51 -34.82 16.26 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.244 0.545 . . . . 0.0 110.982 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.533 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 15.8 t-105 -62.02 -53.92 48.8 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.885 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.59 -30.4 67.17 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.084 0.469 . . . . 0.0 110.191 172.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.7 -48.84 79.75 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.633 177.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -62.16 -30.9 71.37 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.58 -36.89 63.05 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.12 0.486 . . . . 0.0 110.976 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -71.66 -25.74 62.25 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.769 177.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 -15.69 53.71 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.206 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.535 ' NH2' ' HG2' ' A' ' 87' ' ' PRO . 49.4 ttt180 -140.03 147.2 40.02 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.115 0.483 . . . . 0.0 111.461 -177.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -116.46 88.05 2.81 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.793 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.73 -15.43 62.82 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.027 0.441 . . . . 0.0 111.313 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.69 175.49 13.95 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.993 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.6 p -75.3 -176.94 3.29 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 122.634 -0.333 . . . . 0.0 110.457 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.58 62.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.222 0.534 . . . . 0.0 110.637 172.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.3 t -78.04 -52.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.583 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -58.02 -42.32 85.05 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.925 0.393 . . . . 0.0 111.245 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.65 -35.16 74.94 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.338 179.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.0 -51.72 68.49 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 110.917 175.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.37 -34.9 76.88 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.138 0.494 . . . . 0.0 111.485 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.52 -40.42 2.59 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.394 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -98.17 117.91 33.6 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.488 0.315 . . . . 0.0 110.827 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.519 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 64.5 mt -64.78 122.42 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.413 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 47.4 m-70 -83.58 124.85 31.19 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.365 175.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.682 HD11 HG13 ' A' ' 4' ' ' ILE . 98.9 mt -113.35 -64.42 1.31 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.448 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 26.5 m 73.46 154.95 0.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.207 0.527 . . . . 0.0 111.85 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.08 -176.63 5.2 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.07 -64.73 3.91 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 114.285 0.474 . . . . 0.0 114.285 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 9.7 mp0 -56.54 -47.59 79.1 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 117.082 0.441 . . . . 0.0 111.117 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.448 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 29.9 mt-30 -57.09 -35.77 69.8 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.968 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.31 -48.87 60.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.871 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.662 ' HB2' HD22 ' A' ' 109' ' ' LEU . 37.1 tt0 -65.86 -34.95 79.33 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.365 -0.209 . . . . 0.0 111.488 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.1 mt-10 -64.42 -51.08 64.99 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 175.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 m -60.2 -40.31 89.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.248 0.547 . . . . 0.0 110.463 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.608 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . . . -61.43 -47.41 85.86 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.709 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.434 ' HB1' HG13 ' A' ' 106' ' ' VAL . . . -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.315 0.578 . . . . 0.0 111.973 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.36 -41.81 14.2 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.684 -176.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.8 -6.04 13.86 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -166.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -144.71 -69.65 0.29 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.608 ' HG2' ' HB3' ' A' ' 46' ' ' ALA . 25.4 mmt180 -57.99 93.0 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.719 0.771 . . . . 0.0 112.918 -173.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.41 26.93 0.05 OUTLIER Glycine 0 CA--C 1.525 0.685 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.01 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.705 HE21 HD22 ' A' ' 56' ' ' LEU . 11.5 pt20 -165.8 176.47 7.92 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.747 0.308 . . . . 0.0 111.627 -174.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.81 166.98 14.2 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.4 ' O ' ' HA ' ' A' ' 9' ' ' SER . 87.6 m-20 65.08 19.48 11.82 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 175.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.705 HD22 HE21 ' A' ' 53' ' ' GLN . 65.1 mt -84.81 93.47 8.49 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.97 139.62 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.179 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.416 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 63.3 tp -107.4 99.92 9.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 74.2 mt -75.96 105.36 6.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.983 0.42 . . . . 0.0 111.027 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.21 102.6 12.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.767 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -105.2 139.82 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.802 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -79.29 115.33 18.88 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.554 0.216 . . . . 0.0 110.741 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.43 21.36 1.19 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.326 0.584 . . . . 0.0 111.192 177.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.587 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 32.6 tt0 -71.17 -41.1 10.21 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -176.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.587 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 11.7 Cg_endo -55.71 -67.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 121.742 1.628 . . . . 0.0 111.865 173.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.84 58.56 5.33 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 121.122 0.487 . . . . 0.0 112.278 171.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -98.43 -109.41 2.87 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.364 -0.446 . . . . 0.0 112.448 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 14.58 27.21 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.618 0.723 . . . . 0.0 110.558 173.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.568 ' HA ' HH11 ' A' ' 86' ' ' ARG . 0.8 OUTLIER -89.88 -69.54 0.71 Allowed 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.165 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 HD12 ' A' ' 36' ' ' LEU . 58.7 tp -100.29 134.54 43.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -176.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -124.39 128.34 48.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.756 0.312 . . . . 0.0 111.639 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -74.0 106.59 5.76 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.09 136.6 51.41 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.801 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -132.72 102.98 5.89 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -176.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 78.9 p -54.59 -48.28 72.33 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.154 0.502 . . . . 0.0 111.577 175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -80.38 5.57 14.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.402 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.72 -67.13 3.6 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.158 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.51 144.71 29.56 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.899 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 66.14 95.93 0.06 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.168 0.509 . . . . 0.0 111.19 -175.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.801 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 68.7 mtp180 -87.31 117.53 26.14 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.815 -172.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -90.07 113.08 55.89 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.52 115.05 2.41 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.959 1.773 . . . . 0.0 112.052 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -115.63 136.88 52.62 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.933 0.397 . . . . 0.0 111.453 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 38.1 tp -98.44 107.13 19.52 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.099 0.476 . . . . 0.0 110.511 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -83.26 30.77 0.46 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -175.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.568 HH11 ' HA ' ' A' ' 69' ' ' ASP . 4.2 ptm180 -159.14 143.93 11.51 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 122.328 -0.232 . . . . 0.0 111.274 -177.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.535 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 13.9 Cg_endo -57.38 119.14 6.21 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.603 2.202 . . . . 0.0 112.945 177.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 tp -72.49 148.6 44.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.779 -174.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.474 HD22 ' HG3' ' A' ' 21' ' ' ARG . 42.9 mt -96.67 146.81 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 122.102 -0.374 . . . . 0.0 110.529 177.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.04 -39.74 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 O-C-N 122.05 -0.406 . . . . 0.0 111.427 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 t -72.17 -7.59 50.04 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.087 0.47 . . . . 0.0 111.1 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.9 -7.3 30.51 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.408 0.623 . . . . 0.0 110.518 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.4 t -85.82 110.74 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.847 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.636 HG21 ' HD3' ' A' ' 95' ' ' ARG . 4.0 m -64.59 -67.91 0.4 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.636 ' HD3' HG21 ' A' ' 94' ' ' THR . 1.3 mpp_? -115.18 130.9 57.04 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 14.3 pt-20 -103.07 87.8 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.579 0.704 . . . . 0.0 109.641 169.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -85.23 140.2 31.06 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -171.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -83.58 157.37 22.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.134 0.492 . . . . 0.0 111.361 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 2.7 pt? -85.64 119.29 25.81 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.498 0.666 . . . . 0.0 112.758 -176.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -114.18 94.36 4.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 166.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.573 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 65.5 mt -102.6 158.23 16.38 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -159.71 172.18 18.2 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.1 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.5 -82.91 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -117.59 8.67 12.93 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.113 0.482 . . . . 0.0 111.121 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.573 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 71.57 29.7 67.49 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.012 -174.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.731 ' H ' ' HD3' ' A' ' 107' ' ' PRO . 24.1 t -136.4 -22.1 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.453 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.731 ' HD3' ' H ' ' A' ' 106' ' ' VAL . 21.1 Cg_endo -90.25 50.2 1.03 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.697 1.598 . . . . 0.0 113.94 -163.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.591 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.0 OUTLIER -126.14 26.03 6.58 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -171.759 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.662 HD22 ' HB2' ' A' ' 43' ' ' GLN . 1.5 mp -100.65 -12.25 19.33 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.07 -9.17 46.55 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.389 177.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.23 -30.21 27.86 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.259 0.552 . . . . 0.0 111.198 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -100.56 -44.15 5.95 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.262 -172.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 53.5 mt . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 121.378 0.609 . . . . 0.0 111.051 -178.871 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.909 0.385 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.63 144.08 29.13 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.069 0.461 . . . . 0.0 111.701 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 5.2 mt -107.14 146.0 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.405 178.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.423 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 34.3 m-85 -134.97 138.71 44.28 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -176.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.489 ' HZ2' ' CD ' ' A' ' 23' ' ' GLU . 67.2 tttt -151.18 122.65 7.89 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.982 0.42 . . . . 0.0 111.372 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.525 ' N ' HD13 ' A' ' 7' ' ' ILE . 3.3 mp -94.29 135.78 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.126 -178.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.461 ' N ' HD21 ' A' ' 8' ' ' LEU . 2.3 pt? -150.23 167.45 26.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.89 0.376 . . . . 0.0 111.093 178.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 t -71.1 149.34 46.57 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.728 0.299 . . . . 0.0 111.301 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.05 -38.91 71.25 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.875 0.369 . . . . 0.0 110.918 177.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.3 77.54 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.025 0.44 . . . . 0.0 111.699 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -69.7 -40.28 76.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.149 0.5 . . . . 0.0 111.164 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.474 ' NE1' ' HE3' ' A' ' 17' ' ' LYS . 22.1 t-105 -73.23 -46.13 51.97 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.891 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.16 -41.21 92.31 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.827 0.346 . . . . 0.0 110.965 176.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.36 82.03 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.165 0.507 . . . . 0.0 110.846 174.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.55 84.78 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.147 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.474 ' HE3' ' NE1' ' A' ' 13' ' ' TRP . 96.2 mttt -60.06 -37.81 80.96 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.306 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.87 90.7 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.848 0.356 . . . . 0.0 111.807 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -94.92 -3.02 49.41 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.804 0.335 . . . . 0.0 111.812 178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.67 6.96 60.38 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.505 -0.379 . . . . 0.0 113.293 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.6 mtt180 -143.8 157.44 44.37 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 122.505 -0.409 . . . . 0.0 111.408 -175.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 23' ' ' GLU . 46.7 t80 -134.83 178.84 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 170.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 87' ' ' PRO . 67.3 mm-40 92.45 156.12 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.246 1.019 . . . . 0.0 113.703 172.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.04 42.52 24.38 Favored Glycine 0 CA--C 1.526 0.751 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.548 -170.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.1 p -81.56 -176.63 6.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.713 0.292 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.55 -51.01 61.73 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.701 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 36.2 t -69.88 -51.17 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -54.72 -44.17 73.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.864 0.364 . . . . 0.0 111.669 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.13 -35.23 69.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.04 90.02 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.901 0.381 . . . . 0.0 111.408 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -69.84 -39.3 76.51 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.983 0.42 . . . . 0.0 111.07 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 129.41 -25.07 4.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.123 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -159.04 161.44 36.55 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.685 0.394 . . . . 0.0 110.663 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 23' ' ' GLU . 66.0 mt -61.82 140.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.143 0.497 . . . . 0.0 112.312 -173.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -139.32 105.97 5.36 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.053 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.487 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 3.8 mp -98.21 -175.41 3.11 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.515 175.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.5 m -131.97 155.37 48.09 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.22 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.31 173.23 12.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.657 174.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.92 -57.41 11.06 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.667 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.05 -42.79 99.8 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.122 0.486 . . . . 0.0 111.505 178.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -74.29 -15.1 60.98 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.914 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -70.85 -49.77 42.52 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.093 0.473 . . . . 0.0 110.686 176.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.5 -36.99 82.06 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.089 0.471 . . . . 0.0 110.639 174.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.1 -47.18 85.78 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.143 0.497 . . . . 0.0 110.873 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 92.7 m -61.55 -31.23 71.25 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.059 0.457 . . . . 0.0 110.811 175.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.59 -58.43 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.812 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.61 -30.56 55.08 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.982 0.42 . . . . 0.0 112.12 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -84.69 -49.24 8.68 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -116.55 -35.4 4.25 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.528 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 98.5 m-85 -114.06 59.08 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.612 0.72 . . . . 0.0 110.728 -176.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -72.0 -4.66 29.89 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.25 -0.886 . . . . 0.0 112.797 -174.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.57 -96.76 0.1 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.56 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.507 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.0 mt-30 59.79 -164.08 0.22 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.613 0.365 . . . . 0.0 111.651 -176.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.63 120.49 30.9 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.858 -0.526 . . . . 0.0 111.7 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 57.5 83.12 0.11 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.01 0.524 . . . . 0.0 112.185 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.507 HD21 ' HB2' ' A' ' 53' ' ' GLN . 79.6 mt -99.09 123.55 43.46 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.576 177.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.413 ' O ' HD21 ' A' ' 8' ' ' LEU . 48.4 t -87.73 127.62 40.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.573 ' HB2' HD13 ' A' ' 99' ' ' LEU . 67.4 tp -99.6 99.77 10.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.274 174.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 89.0 mt -75.61 107.72 7.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.751 177.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' A' ' 4' ' ' ILE . . . -117.29 114.05 23.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.601 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.448 HG12 HG23 ' A' ' 94' ' ' THR . 43.5 t -127.0 142.53 43.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.487 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.466 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 0.7 OUTLIER -69.86 133.81 47.78 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.456 175.261 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.6 30.54 0.24 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -174.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.413 ' C ' ' H ' ' A' ' 66' ' ' LEU . 0.4 OUTLIER -77.32 -41.59 2.41 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 122.039 -0.413 . . . . 0.0 111.772 174.575 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.466 ' HD2' ' O ' ' A' ' 62' ' ' GLU . 18.2 Cg_exo -70.27 39.21 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.591 2.194 . . . . 0.0 112.405 168.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 70' ' ' LEU . 48.8 tp -61.68 -41.93 98.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.565 0.746 . . . . 0.0 112.394 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 60.71 -114.87 7.02 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.171 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.9 10.61 0.47 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.365 0.602 . . . . 0.0 110.966 175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -102.16 -26.18 13.45 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.483 ' HB3' HD12 ' A' ' 66' ' ' LEU . 38.6 tp -70.5 96.77 1.21 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.438 0.637 . . . . 0.0 110.291 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HG2' ' HB2' ' A' ' 73' ' ' GLU . 39.1 ttmt -103.26 102.29 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.68 -175.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -70.42 98.14 1.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.561 ' HB2' ' HG2' ' A' ' 71' ' ' LYS . 9.7 tp10 -137.9 159.9 40.76 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.716 -169.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.37 179.15 4.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.071 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 88.5 p -134.6 -68.76 0.53 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.036 0.446 . . . . 0.0 111.346 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -106.42 -66.8 0.98 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.77 -107.2 0.63 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.295 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.61 -163.45 10.21 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.928 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 69.7 143.87 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.426 0.631 . . . . 0.0 112.43 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -100.27 117.79 35.21 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.056 0.455 . . . . 0.0 111.747 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -97.96 129.76 30.32 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.447 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.466 ' HB2' HD11 ' A' ' 70' ' ' LEU . 37.8 Cg_endo -66.83 103.93 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.117 1.878 . . . . 0.0 112.533 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 70' ' ' LEU . 74.6 m80 -96.51 154.29 17.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.078 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.0 mt -129.74 145.93 51.52 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 112.358 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -114.12 10.19 17.35 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.836 171.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -118.43 133.97 23.48 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.238 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.587 ' HA ' ' HB2' ' A' ' 23' ' ' GLU . 14.2 Cg_exo -68.51 136.81 37.61 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 121.601 1.534 . . . . 0.0 111.583 173.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.94 101.48 6.87 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.292 0.568 . . . . 0.0 111.707 -171.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.96 120.13 11.39 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.309 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 80.2 t -53.38 -36.14 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.067 0.46 . . . . 0.0 111.565 -177.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.3 t -60.07 -30.43 69.21 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -79.76 -20.23 46.8 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.832 0.349 . . . . 0.0 111.49 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.7 124.94 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 120.683 0.278 . . . . 0.0 111.668 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.448 HG23 HG12 ' A' ' 61' ' ' VAL . 82.6 p -77.18 -57.72 3.68 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 60' ' ' ALA . 6.7 ptp85 -131.54 145.41 51.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.144 0.497 . . . . 0.0 112.113 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -122.36 97.73 5.6 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.145 0.498 . . . . 0.0 111.037 176.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -82.75 118.49 23.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 111.648 -176.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -84.32 105.86 15.48 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.094 0.473 . . . . 0.0 110.486 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' ' 58' ' ' LEU . 73.2 mt -82.85 103.35 12.26 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.188 0.518 . . . . 0.0 112.386 -173.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -91.6 142.01 28.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.194 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.61 127.21 32.58 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -176.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -134.73 167.79 20.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.631 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.63 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 173.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -100.49 3.91 43.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.643 0.259 . . . . 0.0 111.664 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.51 22.55 72.56 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.136 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.9 t -123.14 136.34 26.88 Favored Pre-proline 0 N--CA 1.471 0.588 0 C-N-CA 123.248 0.619 . . . . 0.0 110.256 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.443 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 53.1 Cg_exo -54.35 117.68 4.2 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.676 2.251 . . . . 0.0 113.761 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -75.39 98.24 3.83 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.8 mp -100.43 -40.63 7.38 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.988 -0.445 . . . . 0.0 111.76 173.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.03 -42.9 31.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.617 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -89.56 -29.34 18.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -66.44 -33.3 75.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 59.8 mt . . . . . 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.566 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.78 0.324 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.8 mt -111.59 130.0 55.89 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.627 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.492 HG13 HD22 ' A' ' 36' ' ' LEU . 16.8 pt -114.32 132.22 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-O 121.335 0.588 . . . . 0.0 110.935 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.787 ' HB3' HD23 ' A' ' 58' ' ' LEU . 32.3 m-85 -107.6 135.2 49.45 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.015 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.604 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 50.0 tttm -120.8 124.23 44.55 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 122.355 -0.215 . . . . 0.0 111.207 175.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.54 ' N ' HD13 ' A' ' 7' ' ' ILE . 3.2 mp -93.23 136.91 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.477 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -153.87 174.01 15.15 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.023 0.44 . . . . 0.0 111.622 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -85.87 150.65 24.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.971 0.415 . . . . 0.0 111.41 175.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -34.14 70.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.01 0.433 . . . . 0.0 110.248 177.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.89 -39.55 85.71 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.444 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.47 ' OE1' ' HB2' ' A' ' 25' ' ' SER . 52.7 mt-10 -62.45 -53.32 56.54 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.341 0.591 . . . . 0.0 110.908 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.4 ' CH2' HG12 ' A' ' 90' ' ' VAL . 47.0 t-105 -60.91 -60.36 3.91 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.612 -174.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.529 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -61.18 -31.59 71.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.357 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -65.4 -59.16 4.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.011 0.434 . . . . 0.0 110.67 174.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.7 69.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.993 0.425 . . . . 0.0 111.808 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HE2' ' HA ' ' A' ' 14' ' ' ASP . 37.2 ttpt -71.21 -26.69 63.05 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.931 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.56 -30.62 52.73 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.819 172.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 7.7 mm-40 -78.97 -29.63 44.01 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.934 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.52 -2.48 65.01 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.157 -0.474 . . . . 0.0 113.214 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 21' ' ' ARG . 10.3 ptm180 -148.21 125.24 11.36 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 122.404 -0.468 . . . . 0.0 111.925 -174.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.604 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 53.6 t80 -93.84 116.96 29.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.04 0.448 . . . . 0.0 110.505 176.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -109.96 9.96 24.32 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -174.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.95 175.6 20.93 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.844 -0.693 . . . . 0.0 114.551 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.47 ' HB2' ' OE1' ' A' ' 12' ' ' GLU . 38.8 t -128.52 -175.81 3.63 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.006 0.522 . . . . 0.0 110.889 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.46 -33.02 63.26 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -45.91 71.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.418 0.627 . . . . 0.0 111.051 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.508 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 14.7 m-20 -62.6 -38.6 90.8 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.898 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.55 -21.92 60.23 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.648 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.5 -39.98 85.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.053 0.454 . . . . 0.0 110.877 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.46 -59.4 2.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.368 0.604 . . . . 0.0 110.734 171.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 154.71 -49.32 0.49 Allowed Glycine 0 CA--C 1.525 0.68 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.737 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -128.93 169.43 14.65 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.607 0.363 . . . . 0.0 110.852 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.0 mt -54.59 134.06 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.824 0.345 . . . . 0.0 111.274 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.508 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 25.5 p80 -143.3 123.61 13.82 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.212 0.53 . . . . 0.0 111.761 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.597 ' HG ' ' HB2' ' A' ' 6' ' ' LYS . 5.0 mp -96.58 -163.06 1.01 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.676 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.9 p -137.76 150.09 46.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.837 0.351 . . . . 0.0 111.327 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -98.91 109.53 22.27 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -176.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.78 -103.78 0.26 Allowed Glycine 0 CA--C 1.53 1.002 0 N-CA-C 114.579 0.592 . . . . 0.0 114.579 173.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.06 -42.01 84.55 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.788 0.328 . . . . 0.0 111.642 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -53.21 -28.71 28.24 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.017 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.48 -56.56 13.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.486 178.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -61.43 -43.04 99.57 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.373 178.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.42 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 18.8 mm-40 -55.55 -57.0 13.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.943 177.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 84.6 m -57.3 -38.46 74.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.942 0.401 . . . . 0.0 111.363 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.15 83.38 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.966 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.86 -24.65 28.47 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 67.1 mttm -88.87 -59.01 2.34 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -97.18 -33.87 11.33 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -170.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -98.75 64.47 1.48 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.506 0.669 . . . . 0.0 110.853 -173.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.472 ' NE ' ' HA ' ' A' ' 51' ' ' ARG . 4.5 mmp_? -109.36 139.14 44.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.804 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.24 39.85 93.06 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 114.959 0.744 . . . . 0.0 114.959 174.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.523 ' HB2' HD23 ' A' ' 56' ' ' LEU . 45.0 mt-30 -116.14 142.74 46.42 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 117.351 0.576 . . . . 0.0 111.116 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.49 127.63 32.44 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 58.95 84.1 0.11 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.429 177.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.523 HD23 ' HB2' ' A' ' 53' ' ' GLN . 85.6 mt -101.65 134.96 43.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.274 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.8 t -113.09 152.96 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 110.928 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.787 HD23 ' HB3' ' A' ' 5' ' ' TYR . 3.2 tt -129.2 114.88 16.85 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.008 0.433 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.494 HD23 HG13 ' A' ' 93' ' ' VAL . 86.5 mt -90.83 107.22 19.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.996 0.426 . . . . 0.0 110.873 177.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -95.87 107.37 19.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.505 177.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.23 143.91 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.014 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -72.27 127.97 34.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 122.096 -0.377 . . . . 0.0 110.604 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.15 -47.91 71.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.037 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 63.38 161.86 0.12 Allowed Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.79 -62.15 0.23 Allowed 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.485 2.123 . . . . 0.0 112.963 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 19.0 66.03 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -44.46 130.95 7.38 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 115.067 -0.969 . . . . 0.0 114.918 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 78.66 -24.67 0.21 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -69.0 -42.29 76.67 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.648 -0.657 . . . . 0.0 111.053 172.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.99 143.3 32.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 111.01 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -153.61 132.08 12.11 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.809 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -77.84 64.05 3.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.701 0.762 . . . . 0.0 110.55 176.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -80.03 132.56 36.02 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.644 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -147.23 165.8 28.96 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.122 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 55.7 m -122.42 -178.08 3.8 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.779 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 75.18 -47.37 0.61 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 165.43 -34.42 0.25 Allowed Glycine 0 CA--C 1.524 0.624 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.689 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.22 -149.08 5.35 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.294 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 64.03 -175.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.124 0.488 . . . . 0.0 111.951 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.416 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 38.4 ptt180 -160.07 135.74 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.783 0.325 . . . . 0.0 111.369 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.412 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 92.3 m-85 -131.21 123.21 19.57 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 173.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.64 95.06 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 121.942 1.761 . . . . 0.0 112.637 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.412 ' HD2' ' O ' ' A' ' 81' ' ' PHE . 12.0 m170 -88.36 123.12 32.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.19 177.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -101.35 112.56 25.12 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.273 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -82.15 8.25 11.41 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -174.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -111.36 148.64 39.21 Favored Pre-proline 0 N--CA 1.473 0.689 0 O-C-N 122.034 -0.416 . . . . 0.0 110.904 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.66 109.47 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.022 1.815 . . . . 0.0 110.975 171.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.43 104.69 1.29 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.303 0.573 . . . . 0.0 110.825 -171.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.21 137.27 50.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.107 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' A' ' 17' ' ' LYS . 68.0 t -57.68 -34.73 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.8 m -69.46 -9.24 52.83 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.835 -0.621 . . . . 0.0 112.183 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -105.91 -6.99 18.44 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.926 0.393 . . . . 0.0 111.826 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.494 HG13 HD23 ' A' ' 59' ' ' LEU . 58.7 t -69.74 110.46 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 122.024 -0.422 . . . . 0.0 111.233 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.515 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 85.1 m -48.81 -58.52 4.68 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -147.78 138.42 23.18 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.358 0.599 . . . . 0.0 112.104 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.89 118.88 35.46 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.442 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.97 108.45 12.95 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 122.025 -0.422 . . . . 0.0 111.969 -178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.0 126.59 31.23 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.234 0.54 . . . . 0.0 110.866 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -83.87 111.1 18.92 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -74.85 -11.72 60.21 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 177.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.3 mt 65.64 -167.43 0.21 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.693 0.397 . . . . 0.0 111.261 -176.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -149.05 -172.85 4.22 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 122.289 -0.257 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -28.49 65.42 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.68 -3.63 58.74 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.148 0.499 . . . . 0.0 110.649 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.11 -6.83 61.79 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 116.057 -0.519 . . . . 0.0 112.989 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.98 133.34 39.41 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.669 -0.312 . . . . 0.0 111.344 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.96 118.63 5.66 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.158 1.905 . . . . 0.0 112.354 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -66.3 97.99 0.44 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.34 0.59 . . . . 0.0 112.186 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.1 mp -100.17 -15.78 18.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.948 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -53.84 -33.39 49.61 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.759 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -68.54 -37.04 79.62 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 122.799 0.44 . . . . 0.0 111.652 174.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -85.45 -30.17 23.73 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -173.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 40.0 mt . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -176.272 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.508 HG23 ' HB1' ' A' ' 63' ' ' ALA . 14.0 m . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.502 HD22 ' HA ' ' A' ' 62' ' ' GLU . 0.4 OUTLIER -128.46 132.0 48.39 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.931 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.563 HD13 HD21 ' A' ' 36' ' ' LEU . 14.1 pt -114.16 145.76 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 58' ' ' LEU . 77.9 m-85 -123.81 146.5 48.31 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.726 -176.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.686 ' HB3' ' HZ1' ' A' ' 6' ' ' LYS . 6.4 ttpm? -156.35 125.28 5.99 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.252 -0.28 . . . . 0.0 111.433 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 55.6 mt -94.91 135.94 27.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 120.797 0.332 . . . . 0.0 111.808 -178.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -143.79 172.03 13.4 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.624 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.6 m -76.0 142.57 41.85 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.852 0.358 . . . . 0.0 111.587 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -55.94 -44.17 78.12 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.56 80.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.15 0.5 . . . . 0.0 112.127 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -69.42 -43.25 73.76 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.039 0.447 . . . . 0.0 110.95 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.6 t-105 -66.54 -34.75 78.6 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.628 177.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.531 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 24.4 t70 -60.04 -52.08 66.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.338 0.589 . . . . 0.0 110.432 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -55.32 -39.99 70.62 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.105 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . . . -59.82 -45.77 91.31 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.397 175.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.62 ' HZ2' ' HB2' ' A' ' 17' ' ' LYS . 10.5 mtmp? -61.0 -36.0 78.33 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.859 0.361 . . . . 0.0 111.054 176.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -42.41 98.99 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.136 0.494 . . . . 0.0 111.129 174.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 77.0 mm-40 -70.74 -26.61 63.45 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.223 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.5 -1.51 61.1 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.406 -0.426 . . . . 0.0 112.405 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -150.77 134.57 16.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.099 0.56 . . . . 0.0 110.346 -173.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' ' HB3' ' A' ' 16' ' ' ALA . 90.1 t80 -134.9 130.25 35.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.85 0.357 . . . . 0.0 111.55 -176.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.664 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 1.7 pm0 -100.69 -75.19 0.59 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.294 175.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.664 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . -157.88 -123.62 0.75 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.717 -176.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.2 t -175.69 -164.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.583 -0.363 . . . . 0.0 111.1 -173.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.89 -63.29 1.23 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.6 p -55.8 -40.33 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-O 121.119 0.485 . . . . 0.0 111.509 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -54.68 44.02 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.426 177.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.09 -13.4 61.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.04 -54.66 23.09 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.753 0.311 . . . . 0.0 110.614 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.42 -42.19 25.99 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.655 0.264 . . . . 0.0 111.229 174.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.42 13.42 7.51 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 170.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -148.41 139.27 23.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.852 0.826 . . . . 0.0 112.292 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mt -65.02 87.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.481 0.658 . . . . 0.0 111.157 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -93.29 112.07 23.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.563 HD21 HD13 ' A' ' 4' ' ' ILE . 4.8 mp -94.71 -160.65 0.79 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.667 176.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.5 p -142.88 153.03 42.73 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.867 0.365 . . . . 0.0 111.0 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.22 178.82 5.49 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.851 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.65 -67.56 2.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.035 -0.603 . . . . 0.0 113.653 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 3.3 mp0 -56.08 -42.77 77.22 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 122.642 -0.328 . . . . 0.0 111.12 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.481 ' NE2' ' HB1' ' A' ' 79' ' ' ALA . 82.8 mt-30 -56.56 -44.06 80.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.834 0.35 . . . . 0.0 111.428 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.41 95.96 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.995 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.586 ' HB2' HD11 ' A' ' 109' ' ' LEU . 34.2 tt0 -64.1 -37.98 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.605 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.8 mt-10 -62.51 -51.77 66.12 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.877 0.37 . . . . 0.0 110.956 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 63.9 m -60.84 -35.27 76.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.027 0.442 . . . . 0.0 110.886 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.492 ' HB1' ' HG3' ' A' ' 107' ' ' PRO . . . -67.85 -48.82 65.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.743 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.7 -14.82 55.68 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.073 0.463 . . . . 0.0 111.606 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -98.98 -63.05 1.16 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.412 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -84.9 -49.06 8.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.165 0.507 . . . . 0.0 112.136 -176.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -97.42 56.1 1.31 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.961 0.41 . . . . 0.0 111.469 -173.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.85 -33.95 38.52 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 170.77 44.99 0.03 OUTLIER Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.11 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.516 ' HB2' HD22 ' A' ' 56' ' ' LEU . 85.2 mt-30 -79.06 133.47 36.79 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.896 0.379 . . . . 0.0 111.713 -174.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.93 61.41 5.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.131 0.491 . . . . 0.0 112.154 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -171.79 29.9 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.439 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 53' ' ' GLN . 22.3 mt -106.56 141.77 37.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 88.1 t -125.88 117.55 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.548 174.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.519 ' HB3' ' HB1' ' A' ' 97' ' ' ALA . 66.0 tp -93.14 100.08 12.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.707 178.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.6 mt -75.81 109.35 9.35 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.719 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.4 ' HB2' ' HB3' ' A' ' 95' ' ' ARG . . . -99.57 112.04 24.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 175.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.1 t -120.72 138.33 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 121.008 0.433 . . . . 0.0 112.148 -175.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.502 ' HA ' HD22 ' A' ' 3' ' ' LEU . 9.0 pt-20 -69.23 108.4 3.63 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.722 0.772 . . . . 0.0 110.281 175.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.508 ' HB1' HG23 ' A' ' 2' ' ' THR . . . -85.69 1.56 48.9 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -169.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.539 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 39.8 mt-10 -80.76 -49.94 1.06 Allowed Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 76.0 Cg_exo -52.5 -48.63 20.9 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 122.336 2.024 . . . . 0.0 113.06 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 pp -92.79 10.79 29.4 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -57.78 -28.29 60.16 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 114.652 0.621 . . . . 0.0 114.652 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -66.31 -26.44 67.31 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.361 0.581 . . . . 0.0 111.533 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.37 11.84 30.48 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.259 177.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 82' ' ' PRO . 42.0 tp -113.69 102.97 10.76 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.36 107.32 19.07 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 59.9 m95 -69.39 84.57 0.4 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.793 0.806 . . . . 0.0 109.489 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -119.85 120.49 36.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.287 -167.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.12 89.26 1.14 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.02 0.438 . . . . 0.0 111.409 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.5 p -75.2 78.89 2.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.685 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 63.37 178.52 0.16 Allowed 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.498 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.65 -66.93 2.66 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.97 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.58 -19.84 2.03 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.794 -178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.481 ' HB1' ' NE2' ' A' ' 41' ' ' GLN . . . -83.84 129.18 34.94 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.209 0.528 . . . . 0.0 112.006 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.3 mtp85 -70.85 104.35 2.89 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.478 176.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -94.4 123.27 59.09 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 120.802 0.334 . . . . 0.0 111.419 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.531 ' HB2' HD11 ' A' ' 70' ' ' LEU . 40.9 Cg_endo -67.42 109.15 1.74 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.531 2.154 . . . . 0.0 112.385 177.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -100.02 106.51 18.28 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.403 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.8 tp -93.5 138.67 31.56 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.97 0.414 . . . . 0.0 111.123 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.93 29.81 7.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 28.7 mmt180 -138.11 141.15 31.15 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 122.538 0.335 . . . . 0.0 111.711 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.97 120.36 7.58 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.769 2.312 . . . . 0.0 112.298 177.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 62.7 tp -81.23 110.86 17.1 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.063 0.459 . . . . 0.0 111.527 -177.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.28 136.26 53.22 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.215 -0.303 . . . . 0.0 110.448 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.521 HG22 ' HA ' ' A' ' 17' ' ' LYS . 91.4 t -58.37 -41.17 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.247 0.546 . . . . 0.0 110.935 178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.2 t -70.94 -10.08 59.03 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.828 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -95.73 -15.0 22.91 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.975 0.417 . . . . 0.0 111.333 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.25 145.0 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.968 0.413 . . . . 0.0 111.285 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.1 m -80.26 -50.77 9.76 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.909 0.385 . . . . 0.0 111.298 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 tpp180 -150.14 143.95 25.38 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.271 0.558 . . . . 0.0 111.788 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 9.1 pt-20 -116.41 98.76 6.75 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.081 173.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.519 ' HB1' ' HB3' ' A' ' 58' ' ' LEU . . . -89.09 87.36 7.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.165 0.507 . . . . 0.0 111.72 -176.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -67.95 103.93 1.6 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.333 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.3 tp 60.11 101.64 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.026 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.522 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 13.8 t70 -119.51 89.86 3.21 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.043 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.49 164.04 22.79 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 0.0 112.094 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.859 ' HB2' ' HB2' ' A' ' 108' ' ' GLN . 5.9 t70 -111.74 -169.41 1.46 Allowed 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.019 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.14 -25.75 61.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -89.41 0.93 56.49 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 75.96 5.56 80.36 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.69 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.4 t -89.45 135.8 30.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 122.32 0.248 . . . . 0.0 110.509 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.522 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 20.4 Cg_endo -59.44 95.95 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.289 1.993 . . . . 0.0 111.586 175.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.859 ' HB2' ' HB2' ' A' ' 102' ' ' ASP . 2.6 tp-100 -83.83 44.53 1.0 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.732 0.777 . . . . 0.0 110.699 -174.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.12 5.82 0.32 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.145 -0.934 . . . . 0.0 113.186 -176.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.95 -34.95 31.46 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.688 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -65.08 -27.63 68.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.034 0.445 . . . . 0.0 111.281 174.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -80.26 -24.2 40.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 120.973 0.416 . . . . 0.0 110.745 173.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.5 mt . . . . . 0 N--CA 1.47 0.572 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.77 -176.195 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.37 99.43 4.13 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.948 0.404 . . . . 0.0 111.714 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.463 HD13 HD12 ' A' ' 36' ' ' LEU . 15.4 pt -104.86 142.66 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 110.69 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -125.19 152.22 44.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.225 0.536 . . . . 0.0 112.098 -172.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HZ3' ' CG ' ' A' ' 28' ' ' ASP . 62.6 tttp -147.54 106.66 3.86 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.613 175.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -91.51 137.62 21.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.229 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.18 172.62 17.29 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.001 0.429 . . . . 0.0 111.268 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 94.4 p -76.24 146.4 39.05 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.054 0.454 . . . . 0.0 111.43 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -41.92 62.07 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.555 -179.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.46 -51.07 71.46 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.81 -29.48 69.96 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.028 0.442 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -70.23 -44.69 68.04 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.143 175.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -33.38 72.93 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.221 -0.3 . . . . 0.0 111.114 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.53 -40.96 88.9 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.853 175.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.58 79.52 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.379 174.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -58.6 -37.19 75.29 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.066 0.46 . . . . 0.0 111.211 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.73 -52.77 61.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.687 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 11.5 pt20 -77.24 -10.47 59.44 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 81.41 -45.14 3.18 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-O 121.354 0.419 . . . . 0.0 112.678 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -94.17 -173.93 3.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.451 0.643 . . . . 0.0 111.208 175.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -141.23 94.68 2.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.581 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -72.42 -20.91 61.34 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.91 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.85 152.89 6.67 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.043 -0.526 . . . . 0.0 113.073 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 86.2 p -91.12 -171.66 3.05 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.97 -53.57 15.63 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 64.0 t -59.88 -53.75 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.526 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 12.9 m-20 -57.96 -47.5 82.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.237 0.541 . . . . 0.0 111.713 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.89 -16.81 62.71 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.697 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -55.66 7.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -79.03 -51.59 9.38 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.44 -34.23 0.59 Allowed Glycine 0 CA--C 1.529 0.926 0 C-N-CA 120.298 -0.953 . . . . 0.0 114.561 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -131.1 157.08 44.07 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 117.455 0.627 . . . . 0.0 111.94 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.734 HD11 HD12 ' A' ' 88' ' ' LEU . 66.9 mt -70.58 114.83 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.577 0.703 . . . . 0.0 111.989 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -81.43 124.62 29.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.845 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.463 HD12 HD13 ' A' ' 4' ' ' ILE . 81.6 mt -109.82 111.31 22.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.702 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -77.85 105.85 9.31 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.288 0.566 . . . . 0.0 111.917 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.91 101.92 3.94 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.95 -95.99 0.01 OUTLIER Glycine 0 CA--C 1.532 1.098 0 N-CA-C 114.706 0.643 . . . . 0.0 114.706 173.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.39 -43.48 61.93 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.287 0.565 . . . . 0.0 111.366 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.13 -37.08 85.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.173 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.08 -44.66 97.03 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.628 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -67.0 -36.9 83.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.26 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.38 -56.7 17.4 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.912 0.386 . . . . 0.0 110.805 175.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.9 m -57.59 -38.56 75.07 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 111.377 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.797 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -68.34 -39.14 82.02 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.68 -19.25 60.34 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 111.712 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -93.2 -57.88 2.48 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.102 0.477 . . . . 0.0 111.565 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.71 -55.72 3.84 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -92.29 17.75 9.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -171.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -64.97 113.76 4.09 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.934 0.397 . . . . 0.0 111.428 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.77 25.96 73.96 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 114.237 0.455 . . . . 0.0 114.237 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -99.97 163.46 12.43 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 117.352 0.576 . . . . 0.0 111.451 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -109.21 174.18 5.98 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.862 -179.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 62.52 26.01 15.47 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.841 0.456 . . . . 0.0 112.029 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -88.47 111.48 21.86 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.75 135.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 121.006 0.431 . . . . 0.0 110.455 174.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 tt -102.25 106.23 17.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.037 0.446 . . . . 0.0 110.465 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.476 HD21 HG21 ' A' ' 93' ' ' VAL . 61.3 mt -84.97 107.29 17.03 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.691 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.504 ' HB1' ' HB3' ' A' ' 95' ' ' ARG . . . -102.96 117.86 35.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.743 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 4' ' ' ILE . 53.4 t -117.57 116.24 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.518 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.62 95.77 0.89 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -42.53 -65.65 0.45 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -170.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 64.75 158.35 0.12 Allowed Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 120.789 0.328 . . . . 0.0 110.976 -173.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 57.36 3.4 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.234 1.956 . . . . 0.0 112.809 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.581 HD11 ' N ' ' A' ' 67' ' ' GLY . 1.6 pp -67.32 -28.88 68.35 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.581 ' N ' HD11 ' A' ' 66' ' ' LEU . . . 176.35 154.08 11.31 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.741 -179.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.51 -23.89 67.58 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.118 0.485 . . . . 0.0 111.438 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -65.71 -9.54 28.76 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.107 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 84' ' ' LEU . 57.8 tp -98.54 100.89 12.17 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 168.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -116.36 133.47 55.99 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.094 0.473 . . . . 0.0 112.067 -176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -73.97 91.51 2.03 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.33 0.586 . . . . 0.0 110.259 172.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.31 143.08 35.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.173 -174.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -115.2 91.85 3.74 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 174.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.3 m -69.7 168.39 15.03 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.859 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.0 tpp85 -58.19 95.64 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.089 0.471 . . . . 0.0 111.354 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.87 -73.25 0.26 Allowed Glycine 0 CA--C 1.527 0.81 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.227 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 168.3 -158.26 30.89 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.364 -0.446 . . . . 0.0 113.015 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 62.29 -173.22 0.15 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -126.69 128.03 46.06 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.733 178.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -121.64 94.72 48.36 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.576 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.14 103.18 0.73 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.018 1.812 . . . . 0.0 112.226 178.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -101.41 115.52 30.7 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.336 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' A' ' 70' ' ' LEU . 30.2 tp -96.32 108.21 20.68 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.05 0.452 . . . . 0.0 109.938 175.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -81.0 55.32 2.44 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 120.891 0.377 . . . . 0.0 111.585 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -141.12 161.44 53.4 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.17 103.64 1.45 Allowed 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.532 2.155 . . . . 0.0 110.963 163.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.734 HD12 HD11 ' A' ' 34' ' ' ILE . 10.0 mp -75.71 122.86 24.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -169.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.1 mt -71.94 106.73 4.35 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.832 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 90' ' ' VAL . 42.3 t 54.14 39.1 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-O 122.2 1.0 . . . . 0.0 109.408 -171.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.716 ' HB2' HG22 ' A' ' 93' ' ' VAL . 70.9 m 56.5 19.85 4.44 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.36 -174.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 46.17 36.17 3.03 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.069 0.938 . . . . 0.0 110.813 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.716 HG22 ' HB2' ' A' ' 91' ' ' SER . 10.7 t -68.07 104.16 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.833 -176.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 70.0 m -74.73 -49.63 20.38 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.37 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.504 ' HB3' ' HB1' ' A' ' 60' ' ' ALA . 13.0 ttm180 -115.52 138.95 50.51 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.302 0.572 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -132.0 123.5 27.44 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.12 -176.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -147.31 146.75 29.82 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.47 131.81 39.25 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.213 174.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.64 HD11 ' HB3' ' A' ' 107' ' ' PRO . 53.9 tp -63.97 128.2 34.77 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -173.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -91.96 112.39 24.3 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.679 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.8 mt -94.75 160.61 14.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.625 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -102.91 -171.44 1.95 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 111.605 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.01 15.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -111.55 -13.18 13.86 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.46 14.06 36.47 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.656 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.57 124.72 43.37 Favored Pre-proline 0 CA--C 1.541 0.625 0 O-C-N 122.647 -0.326 . . . . 0.0 111.279 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.797 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 53.0 Cg_exo -55.71 114.85 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.862 2.374 . . . . 0.0 113.177 177.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -75.61 84.9 2.65 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.347 0.594 . . . . 0.0 112.163 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.406 HD23 ' HB2' ' A' ' 42' ' ' ALA . 4.3 mp -81.7 -11.55 59.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.52 174.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -54.79 -33.15 55.58 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.822 176.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.93 -27.73 63.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.15 0.5 . . . . 0.0 110.935 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -79.16 -44.86 21.09 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.235 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.541 0.6 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.595 -175.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.8 p . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 120.894 0.378 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.07 134.58 38.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.85 0.357 . . . . 0.0 111.675 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.462 HG23 ' HB2' ' A' ' 63' ' ' ALA . 22.5 pt -116.39 143.65 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.811 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 58.1 m-85 -126.24 135.63 51.82 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.965 0.412 . . . . 0.0 112.061 -175.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -134.44 115.01 13.49 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.373 173.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.8 mt -90.56 131.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.735 0.302 . . . . 0.0 110.778 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.407 ' N ' HD21 ' A' ' 8' ' ' LEU . 1.9 pt? -147.61 161.2 41.63 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.034 0.445 . . . . 0.0 111.465 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.7 p -69.92 155.66 40.24 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.17 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.9 tpt85 -55.61 -33.3 63.85 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.93 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.81 -56.24 21.51 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.904 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -52.88 -47.58 67.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.244 0.545 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -70.43 -41.35 73.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.313 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.99 -52.67 58.51 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 110.735 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.62 -50.76 64.97 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.007 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 22' ' ' PHE . . . -58.46 -43.24 88.79 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.527 177.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -61.56 -39.66 91.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.936 0.398 . . . . 0.0 111.257 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.96 -33.59 65.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 176.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -74.97 -24.23 58.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.514 176.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.56 -10.43 61.91 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.523 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -159.08 141.51 13.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.519 . . . . 0.0 112.403 -178.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.518 ' CZ ' HD21 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -120.32 116.09 24.85 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.402 0.62 . . . . 0.0 111.573 173.411 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 87' ' ' PRO . 10.1 pt-20 -76.64 2.47 14.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.891 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 129.32 166.39 11.9 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.881 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 51.3 m -75.97 176.5 7.84 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.732 -0.275 . . . . 0.0 110.744 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.6 -52.66 63.03 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.035 0.445 . . . . 0.0 111.223 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.52 -50.21 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.286 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 2.4 m-20 -52.46 -60.53 3.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.95 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.49 -28.15 66.78 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.218 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.45 -46.25 70.32 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -88.45 -32.21 18.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.92 -66.25 0.31 Allowed Glycine 0 CA--C 1.526 0.773 0 C-N-CA 120.17 -1.014 . . . . 0.0 114.513 174.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -111.66 162.44 15.19 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.383 0.611 . . . . 0.0 112.256 -172.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.551 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 61.3 mt -66.78 136.27 27.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.606 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.405 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 12.4 m-70 -92.14 120.17 32.48 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.012 0.435 . . . . 0.0 111.794 -178.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.691 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 67.1 mt -116.83 169.16 9.6 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.183 175.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.0 m -139.56 154.96 47.75 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.081 0.467 . . . . 0.0 111.712 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.23 113.61 25.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.483 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.3 -107.09 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 114.343 0.497 . . . . 0.0 114.343 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -50.02 -47.08 53.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.043 0.537 . . . . 0.0 112.439 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -57.25 -25.63 59.47 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.34 -49.07 46.12 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 111.002 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.565 ' HB2' HD12 ' A' ' 109' ' ' LEU . 55.8 tt0 -65.85 -36.76 84.35 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.021 0.439 . . . . 0.0 110.856 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.98 -52.61 64.27 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.064 174.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.5 m -57.84 -33.33 68.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.807 0.336 . . . . 0.0 111.128 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.03 -54.48 45.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.902 0.382 . . . . 0.0 110.87 174.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.17 -30.32 69.26 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.024 0.44 . . . . 0.0 111.978 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -76.81 -46.79 23.61 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -110.36 -57.56 2.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.406 0.622 . . . . 0.0 112.385 -174.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.52 ' HB3' HD12 ' A' ' 56' ' ' LEU . 74.6 m-85 -95.2 60.65 2.34 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.423 0.63 . . . . 0.0 111.275 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -73.05 -34.54 66.35 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -174.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 176.91 65.88 0.06 OUTLIER Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.528 -0.844 . . . . 0.0 113.815 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.57 24.63 10.82 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.54 -0.388 . . . . 0.0 111.815 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 55.48 120.85 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.2 m120 64.74 89.44 0.09 Allowed 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.678 0.752 . . . . 0.0 111.809 -176.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.52 HD12 ' HB3' ' A' ' 50' ' ' PHE . 58.5 mt -121.24 111.35 17.27 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.779 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 55.4 t -84.99 128.88 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.329 0.585 . . . . 0.0 112.475 -171.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.529 ' HB2' HD13 ' A' ' 99' ' ' LEU . 66.5 tp -97.06 115.1 26.88 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.239 172.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 83.8 mt -88.89 107.74 19.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 0.0 110.971 176.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.14 100.67 10.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.596 178.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.488 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 48.3 t -114.69 132.35 64.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.722 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.9 92.43 1.26 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 171.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -45.06 -66.78 0.35 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -163.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.8 mm-40 68.69 157.43 0.15 Allowed Pre-proline 0 N--CA 1.473 0.682 0 CA-C-O 121.094 0.473 . . . . 0.0 111.129 -168.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -59.06 -41.34 62.03 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.929 1.752 . . . . 0.0 112.194 171.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.3 mt 70.81 -53.12 0.67 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.946 0.898 . . . . 0.0 111.002 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.17 -77.61 0.05 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.83 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -141.93 7.19 1.83 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 123.16 0.584 . . . . 0.0 110.695 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.54 ' OD2' ' HG3' ' A' ' 86' ' ' ARG . 4.7 m-20 -67.95 -52.1 39.91 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -164.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.8 tp -69.27 97.92 0.99 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.712 0.768 . . . . 0.0 111.419 -170.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -99.23 105.15 17.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.222 -177.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -75.06 101.67 4.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.201 0.524 . . . . 0.0 110.639 176.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.97 102.44 2.41 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.608 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -108.24 86.09 2.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.063 0.459 . . . . 0.0 110.808 175.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -110.54 -150.96 0.47 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.058 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.4 mtm180 -67.54 79.34 0.17 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.308 0.575 . . . . 0.0 110.854 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.47 160.23 22.23 Favored Glycine 0 CA--C 1.525 0.694 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.711 -178.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.87 -34.33 21.92 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.699 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -83.37 132.5 34.99 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 122.433 -0.451 . . . . 0.0 112.055 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -89.42 116.59 27.72 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.828 0.347 . . . . 0.0 110.773 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -98.99 112.33 62.72 Favored Pre-proline 0 N--CA 1.472 0.666 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.691 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 17.6 Cg_exo -66.41 135.5 39.77 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.528 2.152 . . . . 0.0 113.404 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -121.44 154.45 36.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.475 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.551 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 23.8 tp -123.09 140.81 52.64 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.568 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -82.17 -62.46 1.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.54 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 13.0 mtm-85 -71.87 155.76 91.73 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -174.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.538 ' HA ' ' HA ' ' A' ' 23' ' ' GLU . 51.9 Cg_exo -56.76 115.8 2.74 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.313 2.009 . . . . 0.0 111.516 168.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.518 HD21 ' CZ ' ' A' ' 22' ' ' PHE . 2.5 tt -64.83 116.6 6.49 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 111.715 -171.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.1 mt -78.64 128.96 34.19 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.049 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.52 -33.76 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-O 120.764 0.316 . . . . 0.0 111.483 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 63.7 p -65.46 -28.09 68.97 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.847 0.356 . . . . 0.0 111.603 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.57 -20.11 58.84 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.03 119.42 17.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.949 175.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.488 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 57.0 p -74.93 -63.7 1.2 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -120.45 142.86 48.86 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.613 0.72 . . . . 0.0 112.914 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -132.55 148.59 52.38 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.32 176.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.53 138.79 15.68 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -84.14 127.57 34.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.89 0.376 . . . . 0.0 110.389 177.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 58' ' ' LEU . 94.6 mt -91.62 119.26 31.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.122 0.487 . . . . 0.0 112.223 -176.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.58 154.5 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.02 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.484 ' HB3' ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -150.07 149.81 30.84 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.201 0.525 . . . . 0.0 112.183 -176.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -100.48 -172.53 2.22 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.631 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.4 7.84 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.04 -10.74 52.3 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.242 0.544 . . . . 0.0 110.204 177.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.5 36.6 58.88 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.79 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 72.5 t -139.44 116.96 8.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.484 ' HA ' ' HB3' ' A' ' 101' ' ' LEU . 36.5 Cg_endo -66.52 98.85 0.41 Allowed 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 121.951 1.767 . . . . 0.0 110.681 167.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -74.84 84.35 2.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.6 0.714 . . . . 0.0 112.44 -169.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.565 HD12 ' HB2' ' A' ' 43' ' ' GLN . 2.2 pp -96.08 5.68 50.57 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.821 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.55 -24.44 56.53 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.436 -0.412 . . . . 0.0 113.639 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -77.56 -11.39 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.147 0.499 . . . . 0.0 111.353 174.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -98.98 -47.64 5.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.179 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 CA--C 1.539 0.556 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -176.805 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.0 p . . . . . 0 N--CA 1.468 0.45 0 CA-C-O 120.894 0.378 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.1 mt -112.96 130.95 55.94 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.962 0.41 . . . . 0.0 111.66 -177.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.433 HG22 HD21 ' A' ' 70' ' ' LEU . 24.0 pt -105.01 146.17 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.723 174.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.451 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 44.1 m-85 -129.85 164.23 24.58 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.247 0.546 . . . . 0.0 112.148 -172.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HE2' ' HG ' ' A' ' 36' ' ' LEU . 24.5 ttmm -156.52 106.76 2.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.809 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.1 mt -88.89 135.9 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.945 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 8' ' ' LEU . 2.0 pt? -152.24 166.93 30.23 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.952 0.406 . . . . 0.0 111.305 -177.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 t -75.68 150.48 37.9 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.858 0.361 . . . . 0.0 111.096 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.526 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . 8.7 tpt180 -56.82 -35.67 69.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.043 0.449 . . . . 0.0 110.839 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.71 -37.47 73.57 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.373 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -75.88 -38.84 57.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.122 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -69.15 -48.43 62.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.33 -37.67 84.13 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.207 -0.308 . . . . 0.0 111.587 175.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.47 -45.29 92.05 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.064 0.459 . . . . 0.0 110.648 174.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.7 -53.02 62.94 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.563 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HZ2' ' HB2' ' A' ' 17' ' ' LYS . 10.1 mtmp? -61.84 -27.57 68.87 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.887 0.375 . . . . 0.0 111.66 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.63 -51.36 51.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.957 0.408 . . . . 0.0 111.403 176.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -87.88 3.27 49.08 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.85 -1.01 48.79 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.502 -0.38 . . . . 0.0 114.034 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -149.14 149.21 30.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 122.406 -0.467 . . . . 0.0 111.513 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -110.42 132.87 53.8 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.46 0.648 . . . . 0.0 111.872 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -106.61 130.57 54.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.087 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -47.75 -71.28 0.58 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.52 0.568 . . . . 0.0 114.52 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.539 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 44.3 t 179.4 159.34 0.68 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.713 0.405 . . . . 0.0 110.143 -178.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -55.19 35.45 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.3 p -63.15 -33.32 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 111.813 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.539 ' HB2' ' HB3' ' A' ' 25' ' ' SER . 22.1 t0 -62.1 -58.44 7.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.251 0.548 . . . . 0.0 110.481 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.97 -33.83 76.61 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.04 -37.95 89.31 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -75.99 -34.57 59.75 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.755 0.312 . . . . 0.0 110.771 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 165.12 -68.86 0.2 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 120.151 -1.023 . . . . 0.0 114.566 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.55 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 52.9 m-85 -145.45 141.84 28.73 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 122.42 -0.459 . . . . 0.0 111.738 -167.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 62.1 mt -50.96 107.09 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -80.53 127.93 33.01 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.281 0.562 . . . . 0.0 111.474 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.496 ' HG ' ' HE2' ' A' ' 6' ' ' LYS . 7.3 mp -91.32 -46.33 8.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.5 m 66.5 97.06 0.05 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.158 0.504 . . . . 0.0 110.973 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.52 155.92 19.1 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.74 -119.92 18.92 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.721 -0.672 . . . . 0.0 113.939 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -59.74 -40.0 86.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.118 0.485 . . . . 0.0 110.994 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -67.39 -29.13 68.56 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.141 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.19 -50.87 59.39 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.138 0.494 . . . . 0.0 110.895 176.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.41 -47.52 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.251 175.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 33.1 tt0 -61.35 -48.36 81.64 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.302 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -60.82 -37.86 83.43 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 120.952 0.405 . . . . 0.0 111.162 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.43 -40.84 83.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.74 175.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.12 -25.62 61.8 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.024 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 65.1 mttm -74.78 -69.43 0.46 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.39 0.614 . . . . 0.0 111.669 177.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.3 m0 -75.0 -60.68 2.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.503 -0.771 . . . . 0.0 112.4 -170.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.524 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 45.0 m-85 -82.92 -66.33 0.9 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.575 -170.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 70.81 -65.54 0.33 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -151.48 56.19 0.45 Allowed Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.57 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.551 ' HB2' HD22 ' A' ' 56' ' ' LEU . 78.6 mt-30 -99.81 -164.66 1.14 Allowed 'General case' 0 CA--C 1.539 0.544 0 O-C-N 122.774 -0.251 . . . . 0.0 110.834 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.67 -67.19 0.89 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 15.4 p-10 -97.33 67.7 2.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.857 0.837 . . . . 0.0 111.728 -168.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.551 HD22 ' HB2' ' A' ' 53' ' ' GLN . 37.7 mt -94.71 124.78 38.95 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.542 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 t -110.65 148.64 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.26 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.0 tt -122.27 118.77 29.33 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.824 0.345 . . . . 0.0 110.799 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.6 mt -90.85 131.56 36.41 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.56 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -128.53 125.08 37.59 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.904 0.383 . . . . 0.0 111.519 -178.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.99 134.5 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 120.869 0.366 . . . . 0.0 111.128 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -74.53 138.4 43.09 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 175.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.418 ' O ' ' HG ' ' A' ' 66' ' ' LEU . . . -48.39 -70.51 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.491 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 28.2 mt-10 61.24 167.98 0.09 OUTLIER Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.491 ' HD2' ' HB3' ' A' ' 64' ' ' GLU . 82.8 Cg_exo -52.24 5.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.503 0 C-N-CA 123.711 2.941 . . . . 0.0 116.356 176.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 63' ' ' ALA . 4.3 pp -88.35 10.34 20.23 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.315 -0.865 . . . . 0.0 111.656 178.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -71.83 27.13 0.63 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.504 0.562 . . . . 0.0 114.504 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.17 -35.4 9.67 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.23 -0.571 . . . . 0.0 110.247 173.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -78.76 -12.69 60.03 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.13 175.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.433 HD21 HG22 ' A' ' 4' ' ' ILE . 51.5 tp -114.0 134.19 55.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.814 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -137.25 134.57 36.33 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.966 0.413 . . . . 0.0 111.416 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 73.0 m95 -83.66 89.41 7.12 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.97 0.414 . . . . 0.0 110.721 177.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.39 117.6 31.2 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.097 0.475 . . . . 0.0 112.131 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.424 ' HB3' ' HG2' ' A' ' 80' ' ' ARG . . . -89.49 114.12 25.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.037 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.3 m -117.78 36.24 4.38 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -164.26 -36.38 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 0.0 111.657 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 141.17 100.58 0.42 Allowed Glycine 0 CA--C 1.526 0.723 0 C-N-CA 121.182 -0.533 . . . . 0.0 113.038 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.8 -47.05 3.72 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.18 104.45 1.82 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 122.414 -0.463 . . . . 0.0 111.484 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.482 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 50.4 mtm180 -92.9 107.82 19.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.962 0.411 . . . . 0.0 111.365 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -84.31 114.68 56.25 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.408 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.51 111.45 1.66 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.406 2.071 . . . . 0.0 112.245 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 57.8 m170 -106.6 133.93 50.52 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.589 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.8 tp -100.22 120.42 39.87 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.924 0.392 . . . . 0.0 110.293 177.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -79.52 7.09 8.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -174.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -145.43 155.43 53.64 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 122.357 -0.214 . . . . 0.0 111.116 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.31 135.75 61.06 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.683 2.256 . . . . 0.0 113.072 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 61.5 tp -80.49 88.72 5.62 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.053 0.454 . . . . 0.0 111.232 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.2 mt -61.36 141.84 57.33 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.282 -0.261 . . . . 0.0 110.532 176.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 87.9 t -58.17 -27.45 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.05 0.453 . . . . 0.0 111.138 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.2 t -65.69 -23.7 66.83 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.36 -21.12 53.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.782 0.325 . . . . 0.0 111.536 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.8 t -76.73 87.86 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.05 0.453 . . . . 0.0 110.929 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.516 HG21 ' HG3' ' A' ' 95' ' ' ARG . 97.8 m -59.87 -48.55 81.23 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.115 -178.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.516 ' HG3' HG21 ' A' ' 94' ' ' THR . 69.2 mtm180 -134.12 148.13 50.94 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.633 0.254 . . . . 0.0 111.345 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -157.74 153.33 26.4 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.749 0.309 . . . . 0.0 111.609 177.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -169.18 151.26 4.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -73.14 126.31 29.73 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.74 174.83 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -170.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 23.4 t70 -107.91 129.16 55.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.616 -177.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.551 HD22 HD13 ' A' ' 56' ' ' LEU . 80.9 mt -96.56 152.06 18.99 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.993 0.425 . . . . 0.0 111.91 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.638 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 28.1 t70 -86.3 174.71 8.88 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.92 177.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.33 65.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -96.27 9.42 41.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.139 0.495 . . . . 0.0 111.052 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.461 ' O ' HD21 ' A' ' 101' ' ' LEU . . . 93.52 -33.98 4.86 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 121.243 -0.503 . . . . 0.0 113.658 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.8 t -54.41 122.82 40.13 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 31.2 Cg_exo -59.84 103.97 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 112.264 176.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.638 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 83.6 mm-40 -76.55 68.36 2.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.444 0.64 . . . . 0.0 111.77 -177.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 112' ' ' HIS . 2.3 pp -100.32 5.39 44.47 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.538 176.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.93 -49.3 72.26 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.482 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.16 -19.62 62.4 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.215 0.531 . . . . 0.0 111.079 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . 0.445 ' HB3' ' O ' ' A' ' 109' ' ' LEU . 73.3 t60 -76.73 -30.1 56.48 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.349 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.409 HD22 ' CZ ' ' A' ' 5' ' ' TYR . 30.5 mt . . . . . 0 CA--C 1.542 0.641 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.131 -179.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.1 0.476 . . . . 0.0 110.752 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.8 mt -87.8 113.77 23.78 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -174.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.535 HD13 HD22 ' A' ' 36' ' ' LEU . 25.7 pt -98.51 141.79 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 170.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.502 ' HB3' HD11 ' A' ' 58' ' ' LEU . 92.2 m-85 -117.38 147.4 42.68 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.655 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 77.7 tttt -151.93 118.1 5.56 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 7' ' ' ILE . 3.3 mp -93.19 149.57 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-O 120.96 0.41 . . . . 0.0 111.678 -176.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.411 ' N ' HD22 ' A' ' 8' ' ' LEU . 2.3 pt? -160.27 171.44 19.16 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.99 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -79.89 145.65 32.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.86 0.362 . . . . 0.0 111.148 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.43 -29.99 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.524 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.03 -59.48 5.29 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.381 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.86 -34.31 74.4 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.823 0.344 . . . . 0.0 111.639 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -64.32 -47.73 78.3 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.912 0.387 . . . . 0.0 111.869 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.23 -40.12 86.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.464 0.65 . . . . 0.0 110.125 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.68 72.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.027 174.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.91 97.94 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 174.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.54 -35.83 78.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.294 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.17 -27.43 63.82 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.925 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -109.28 -0.78 18.98 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.011 0.434 . . . . 0.0 111.61 176.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.13 -0.53 46.46 Favored Glycine 0 CA--C 1.53 1.013 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 176.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -136.16 155.27 50.39 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.948 -0.737 . . . . 0.0 111.582 -175.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.655 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 44.1 t80 -128.95 160.8 31.54 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.072 172.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.502 ' HB3' HD12 ' A' ' 34' ' ' ILE . 67.1 mt-10 73.96 -168.39 0.11 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.599 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.21 22.44 70.88 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.304 -173.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.3 t -88.39 -177.23 5.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.896 0.478 . . . . 0.0 111.573 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.43 -42.49 32.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.1 t -56.79 -39.61 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 120.903 0.382 . . . . 0.0 111.717 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.34 -50.83 58.34 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.088 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.88 -27.26 68.08 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.79 0.329 . . . . 0.0 111.688 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.44 -56.03 4.89 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.069 0.461 . . . . 0.0 112.039 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -80.49 -29.71 37.35 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 118.25 -27.42 7.35 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.975 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -152.08 166.5 31.42 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.212 0.529 . . . . 0.0 111.597 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.502 HD12 ' HB3' ' A' ' 23' ' ' GLU . 50.4 mt -80.18 149.44 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.798 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -111.86 121.19 44.36 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.007 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.597 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 6.2 mp -119.28 -175.42 2.93 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 171.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.9 m -146.71 153.4 40.21 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.05 -166.83 1.7 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.824 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.8 -69.99 1.11 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 114.138 0.415 . . . . 0.0 114.138 -175.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.18 88.25 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.922 0.392 . . . . 0.0 111.59 -177.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -61.34 -46.24 91.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.489 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.59 99.36 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.742 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -59.9 -48.72 80.55 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 120.989 0.424 . . . . 0.0 111.555 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -73.12 -41.29 64.16 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.4 m -59.5 -42.0 91.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.973 0.416 . . . . 0.0 111.104 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.435 ' HB2' ' HG2' ' A' ' 107' ' ' PRO . . . -58.87 -42.49 89.55 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.063 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.21 68.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -82.44 -63.22 1.42 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.07 0.462 . . . . 0.0 112.058 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -74.31 -40.13 62.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -172.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -117.02 34.45 5.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.128 0.489 . . . . 0.0 110.907 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 51' ' ' ARG . 2.9 ptm180 -36.06 -52.7 0.77 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -176.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.615 ' HA2' HD12 ' A' ' 101' ' ' LEU . . . -156.29 47.25 0.49 Allowed Glycine 0 CA--C 1.522 0.524 0 C-N-CA 120.858 -0.687 . . . . 0.0 113.495 -176.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.541 ' HB2' HD23 ' A' ' 56' ' ' LEU . 64.2 mt-30 -87.5 158.5 18.92 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.722 0.296 . . . . 0.0 110.893 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.38 128.89 34.99 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 67.56 84.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.828 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' A' ' 53' ' ' GLN . 96.1 mt -112.69 129.83 56.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.531 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.41 ' O ' HD22 ' A' ' 8' ' ' LEU . 60.3 t -102.64 130.79 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.057 0.456 . . . . 0.0 111.439 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.511 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.6 tp -99.44 104.03 15.85 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 175.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.412 HD21 HG13 ' A' ' 93' ' ' VAL . 82.7 mt -76.29 109.81 10.29 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.075 0.464 . . . . 0.0 111.376 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -101.12 115.84 31.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.41 175.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 4' ' ' ILE . 51.8 t -126.24 131.86 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.636 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.4 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 18.6 tt0 -92.22 105.28 17.53 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.17 0.509 . . . . 0.0 111.985 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.58 84.85 7.06 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.425 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.589 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 41.2 mt-10 -80.58 -44.8 1.32 Allowed Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 178.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.589 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 10.9 Cg_endo -53.9 -62.27 0.33 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.828 1.685 . . . . 0.0 112.294 177.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.563 HD11 ' HB3' ' A' ' 70' ' ' LEU . 18.6 tp 57.13 22.92 7.97 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.23 0.538 . . . . 0.0 111.985 172.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -93.77 -83.31 1.57 Allowed Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.501 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -102.34 5.56 39.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.029 0.442 . . . . 0.0 111.167 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.508 ' O ' HD13 ' A' ' 84' ' ' LEU . 4.0 p-10 -92.79 -64.17 1.13 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.182 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.563 ' HB3' HD11 ' A' ' 66' ' ' LEU . 42.0 tp -107.89 147.7 30.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.916 0.388 . . . . 0.0 111.09 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -136.63 101.04 4.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.006 0.432 . . . . 0.0 111.94 -174.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -70.28 119.82 15.03 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -158.32 144.63 17.27 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.602 -172.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . . . -149.51 158.1 43.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.251 0.548 . . . . 0.0 112.407 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.6 m -154.78 126.74 7.64 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.176 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 76' ' ' ARG . 3.8 mpt_? 69.83 -59.99 0.49 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 176.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.2 -15.38 44.16 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.352 0.501 . . . . 0.0 114.352 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 79.2 -45.07 2.74 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.608 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.81 134.86 57.51 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.931 0.396 . . . . 0.0 112.047 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.456 ' HA ' ' HB3' ' A' ' 74' ' ' ALA . 83.6 mtt180 -79.1 110.89 14.77 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.153 -177.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -95.17 117.64 66.69 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-O 120.756 0.313 . . . . 0.0 111.712 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -66.82 102.19 0.61 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.661 2.24 . . . . 0.0 112.374 175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -90.94 115.4 27.94 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.133 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 69' ' ' ASP . 55.2 tp -105.24 130.57 53.36 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.707 0.289 . . . . 0.0 110.543 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -110.32 37.11 2.82 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.421 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 20.5 ptp180 -167.55 138.42 2.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 O-C-N 122.452 -0.155 . . . . 0.0 110.986 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 26.8 Cg_exo -62.48 149.33 91.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 122.721 2.281 . . . . 0.0 113.046 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -108.99 118.56 37.11 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.33 0.586 . . . . 0.0 111.282 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -71.04 135.56 47.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.058 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 30.0 m -57.88 -35.24 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -172.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -72.54 -3.77 26.56 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.729 0.3 . . . . 0.0 111.722 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -98.01 -11.86 22.55 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.808 0.337 . . . . 0.0 111.77 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.412 HG13 HD21 ' A' ' 59' ' ' LEU . 57.6 t -66.61 124.81 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 O-C-N 122.319 -0.238 . . . . 0.0 111.407 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 40.8 m -59.72 -38.83 82.74 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.768 0.318 . . . . 0.0 111.645 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -160.85 143.13 12.55 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.301 0.572 . . . . 0.0 112.231 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.3 pt-20 -106.7 84.07 1.95 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.489 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.511 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -74.6 84.31 2.06 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.216 0.532 . . . . 0.0 112.209 -175.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 102.22 1.59 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.573 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 pp -116.15 168.37 10.17 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -122.87 176.12 6.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.521 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.615 HD12 ' HA2' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -158.74 179.07 9.44 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.816 -179.221 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -113.87 170.28 8.38 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.478 0.656 . . . . 0.0 112.127 170.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.75 94.02 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.366 -178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 91.25 -6.58 0.26 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.791 0.836 . . . . 0.0 109.678 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -60.19 -39.89 96.54 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.481 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 t 67.13 141.14 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 123.951 0.442 . . . . 0.0 112.153 169.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.531 ' HD3' HD13 ' A' ' 101' ' ' LEU . 53.2 Cg_exo -35.01 101.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 123.138 2.559 . . . . 0.0 113.888 -173.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -70.4 80.22 0.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.555 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.4 mp -79.39 -23.56 43.2 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.307 -0.406 . . . . 0.0 112.072 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.59 -41.5 26.17 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.635 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -78.05 -13.67 59.79 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -95.58 -13.12 24.67 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.615 0.245 . . . . 0.0 111.173 179.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 42.7 mt . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -175.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.452 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 53.3 p . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.7 mt -81.98 105.96 13.51 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.987 -0.446 . . . . 0.0 111.406 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CG2' ' HB3' ' A' ' 36' ' ' LEU . 13.6 mt -92.35 142.92 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.19 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -130.72 119.42 22.33 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.664 0.269 . . . . 0.0 111.609 -177.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.452 ' HZ1' ' HG ' ' A' ' 36' ' ' LEU . 33.8 ttpt -127.24 123.06 35.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.651 0.262 . . . . 0.0 111.673 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.472 HD11 ' N ' ' A' ' 7' ' ' ILE . 4.1 mp -91.69 138.14 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -178.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -149.69 174.54 12.46 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.189 175.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.9 p -82.48 151.97 26.28 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.943 -0.473 . . . . 0.0 111.063 177.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -30.06 64.37 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.832 0.348 . . . . 0.0 110.497 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.37 39.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.26 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -58.29 -43.55 88.11 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 111.144 178.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.499 ' CH2' HG12 ' A' ' 90' ' ' VAL . 28.4 t-105 -62.74 -51.74 65.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.678 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.545 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 12.4 t70 -59.44 -47.42 85.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.327 0.584 . . . . 0.0 110.784 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.41 -46.71 76.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.467 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.72 74.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.59 ' HZ3' ' HB2' ' A' ' 17' ' ' LYS . 10.4 mtmp? -65.71 -27.92 68.68 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.683 0.278 . . . . 0.0 110.958 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.27 83.68 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.135 0.493 . . . . 0.0 111.091 173.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -80.23 -26.53 39.04 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.235 0.541 . . . . 0.0 110.856 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.06 -10.77 51.87 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.447 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HG2' HD13 ' A' ' 89' ' ' LEU . 24.8 mtt-85 -135.73 121.68 19.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.59 -0.359 . . . . 0.0 110.821 -178.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -78.6 86.67 4.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 172.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.11 80.27 9.24 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.194 0.521 . . . . 0.0 112.089 -174.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.67 -135.35 48.68 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.58 -0.737 . . . . 0.0 114.565 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 28' ' ' ASP . 46.5 t 170.42 177.48 0.05 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.627 0.771 . . . . 0.0 110.25 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.41 -49.12 77.24 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 122.003 -0.436 . . . . 0.0 111.865 -179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.485 HG23 ' NE2' ' A' ' 35' ' ' HIS . 10.7 p -65.33 -24.52 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 111.597 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 25' ' ' SER . 0.3 OUTLIER -64.12 -53.66 46.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.758 175.094 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.27 -30.61 68.42 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 120.621 0.248 . . . . 0.0 111.082 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.17 77.92 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.868 0.366 . . . . 0.0 111.709 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.495 ' HB3' ' CE1' ' A' ' 33' ' ' PHE . 3.5 m-20 -87.91 -29.67 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.103 0.477 . . . . 0.0 111.566 173.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.18 -6.67 81.28 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.902 -170.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.604 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -151.45 143.81 24.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.225 0.61 . . . . 0.0 111.092 -177.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mt -60.53 130.42 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -168.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.485 ' NE2' HG23 ' A' ' 27' ' ' VAL . 33.7 m-70 -72.45 140.12 48.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.736 170.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HZ1' ' A' ' 6' ' ' LYS . 3.4 mp -145.61 -64.51 0.32 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.68 0.276 . . . . 0.0 110.714 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 56.2 m 78.71 160.29 0.19 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.81 177.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -97.72 177.58 5.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.864 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -41.86 -47.97 5.13 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 114.677 0.631 . . . . 0.0 114.677 -175.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -54.61 -69.02 0.14 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.426 0.631 . . . . 0.0 111.781 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.531 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 22.2 mp0 -68.91 -20.09 64.22 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.888 -175.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.96 -56.52 8.71 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.698 0.285 . . . . 0.0 111.358 178.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.449 ' NE2' ' HA ' ' A' ' 108' ' ' GLN . 29.3 tt0 -61.74 -39.82 92.92 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 111.728 0.269 . . . . 0.0 111.728 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -58.97 -56.4 22.75 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.979 0.419 . . . . 0.0 110.935 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -56.02 -34.02 65.44 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.122 176.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.54 -49.42 73.55 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.624 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.24 -33.07 74.69 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.054 0.454 . . . . 0.0 111.911 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -77.05 -53.03 8.31 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.36 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -88.79 -42.26 12.02 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -174.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -112.74 57.12 0.66 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.169 0.509 . . . . 0.0 110.713 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -4.54 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -172.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.88 73.63 0.02 OUTLIER Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.372 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.507 ' HB2' HD22 ' A' ' 56' ' ' LEU . 88.0 mt-30 -107.3 26.0 10.73 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 121.452 0.644 . . . . 0.0 110.996 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 64.46 -78.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.49 63.22 7.22 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.576 0.703 . . . . 0.0 111.367 -172.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.655 HD12 HD21 ' A' ' 101' ' ' LEU . 52.2 mt -88.5 138.92 31.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.606 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.7 t -123.51 141.92 42.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.648 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 8.8 tt -109.38 115.4 29.88 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.899 0.38 . . . . 0.0 110.615 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.1 108.59 13.82 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.87 0.366 . . . . 0.0 111.317 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.04 110.38 22.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.5 t -120.01 116.68 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.45 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.451 ' HG2' ' OG1' ' A' ' 94' ' ' THR . 11.8 pt-20 -79.41 103.38 9.29 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.594 0.711 . . . . 0.0 110.902 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.452 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.16 40.62 0.27 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.142 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -75.85 -45.89 3.98 Favored Pre-proline 0 CA--C 1.548 0.888 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -83.75 -157.23 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 122.216 1.944 . . . . 0.0 112.374 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 69' ' ' ASP . 90.5 mt 67.83 -55.38 0.49 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.366 1.066 . . . . 0.0 112.072 -177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.08 -102.94 1.3 Allowed Glycine 0 CA--C 1.528 0.906 0 CA-C-N 116.213 -0.449 . . . . 0.0 113.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -69.82 -13.92 62.5 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.485 ' HB2' ' HB3' ' A' ' 66' ' ' LEU . 58.1 m-20 -67.27 -17.62 64.87 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.5 tp -123.33 149.88 44.32 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.526 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 8.1 ttpm? -149.25 128.36 12.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.925 0.393 . . . . 0.0 111.308 171.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.463 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 53.4 m95 -72.55 86.79 1.19 Allowed 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -86.17 128.89 34.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.961 -169.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.571 ' HB3' HH11 ' A' ' 80' ' ' ARG . . . -76.58 152.01 36.09 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.482 0.658 . . . . 0.0 112.729 -176.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.0 t -130.93 -178.64 4.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.0 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -55.44 103.45 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.913 0.485 . . . . 0.0 111.682 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.25 -16.62 5.7 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.473 -0.394 . . . . 0.0 112.916 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.45 -2.64 59.18 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.324 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.51 140.35 57.99 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.704 -0.292 . . . . 0.0 111.757 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.571 HH11 ' HB3' ' A' ' 74' ' ' ALA . 24.9 mmm180 -102.66 111.91 24.44 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.734 0.302 . . . . 0.0 111.262 -177.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -107.45 114.15 61.06 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-O 120.637 0.256 . . . . 0.0 111.364 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 43.6 Cg_endo -67.37 103.09 0.75 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.35 2.034 . . . . 0.0 112.819 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.604 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 31.3 m80 -98.91 129.82 45.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.928 176.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.3 tp -95.07 137.26 34.37 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 175.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.507 ' OH ' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 m-85 -105.61 12.91 30.65 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -173.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -141.67 154.44 66.14 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 122.664 0.386 . . . . 0.0 110.695 173.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.6 132.63 52.96 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.532 2.155 . . . . 0.0 113.105 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.6 tp -79.3 105.45 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.863 0.363 . . . . 0.0 111.707 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.424 HD13 ' HG2' ' A' ' 21' ' ' ARG . 3.7 mm? -63.98 123.53 19.24 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.238 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.499 HG12 ' CH2' ' A' ' 13' ' ' TRP . 76.3 t -56.2 -39.44 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.955 0.407 . . . . 0.0 111.815 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.6 t -72.96 -4.53 32.74 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -99.56 -11.49 20.96 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 120.998 0.428 . . . . 0.0 111.378 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -69.25 135.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-O 120.933 0.397 . . . . 0.0 111.706 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.451 ' OG1' ' HG2' ' A' ' 62' ' ' GLU . 61.3 m -65.15 -50.0 67.67 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.064 0.459 . . . . 0.0 111.597 -179.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -155.31 143.09 19.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.284 0.564 . . . . 0.0 111.671 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -97.15 86.49 3.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.335 171.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.514 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -75.98 86.45 2.9 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -171.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -66.81 139.28 57.77 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.924 172.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.463 HD21 ' N ' ' A' ' 99' ' ' LEU . 2.0 pt? -141.2 145.11 35.21 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.143 0.497 . . . . 0.0 112.088 -177.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.63 131.82 34.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.395 172.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.655 HD21 HD12 ' A' ' 56' ' ' LEU . 88.4 mt -71.14 149.84 46.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.119 0.485 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.82 166.15 3.55 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.639 175.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.84 66.8 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.126 0.489 . . . . 0.0 111.7 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -83.41 -10.93 58.11 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.501 0.667 . . . . 0.0 110.078 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.94 18.89 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.695 -0.684 . . . . 0.0 113.008 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 73.4 t -103.91 123.43 41.07 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 83.04 1.04 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 170.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.449 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 2.8 pt20 -80.25 115.37 19.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.433 0.635 . . . . 0.0 112.227 -174.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -88.63 -29.92 19.59 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -47.24 -46.12 21.41 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.414 -0.422 . . . . 0.0 113.556 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -64.93 -40.29 94.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.858 0.361 . . . . 0.0 111.575 177.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -79.02 -24.17 43.86 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -174.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 46.6 mt . . . . . 0 CA--C 1.542 0.658 0 O-C-N 122.321 -0.237 . . . . 0.0 111.287 -178.419 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.466 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.5 pmm? . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m 72.48 -48.53 0.68 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.321 0.649 . . . . 0.0 112.663 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -69.61 96.1 0.91 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.711 173.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 pt -92.2 147.32 5.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.751 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 43.2 m-85 -119.79 147.44 44.64 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -170.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -126.79 123.59 37.74 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.553 171.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.0 mt -96.56 130.1 45.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.731 0.3 . . . . 0.0 111.468 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -147.71 174.55 11.69 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.811 176.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.4 t -79.79 143.97 33.97 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.797 0.332 . . . . 0.0 111.301 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -55.92 -44.1 78.01 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.68 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.5 -37.72 57.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 111.927 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.56 -41.64 65.54 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.131 0.491 . . . . 0.0 110.893 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -64.45 -49.44 71.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.976 -0.557 . . . . 0.0 112.166 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -58.03 -39.53 78.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.717 0.294 . . . . 0.0 111.559 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -50.64 71.43 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.954 0.407 . . . . 0.0 111.241 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -41.7 89.3 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.163 0.506 . . . . 0.0 111.402 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -63.48 -31.08 72.14 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.08 -40.73 78.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -76.41 -30.55 57.49 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.9 1.14 82.81 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.053 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -141.07 146.56 37.3 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.864 0.364 . . . . 0.0 111.966 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -128.04 99.75 5.61 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.12 0.486 . . . . 0.0 110.283 173.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -71.83 163.89 27.0 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.068 0.461 . . . . 0.0 111.563 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.73 111.46 4.2 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.229 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -67.19 158.39 31.43 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.716 0.293 . . . . 0.0 111.645 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.09 -37.12 43.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.975 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.88 -49.04 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 111.292 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.483 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 8.2 m-20 -62.71 -46.23 89.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.57 -33.24 75.45 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.666 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.29 -37.09 86.25 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.978 0.418 . . . . 0.0 111.78 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -81.42 -51.63 8.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.146 0.498 . . . . 0.0 111.291 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 153.46 71.44 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.416 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 68.64 -176.69 0.21 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.897 0.479 . . . . 0.0 111.597 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.66 103.11 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.302 0.572 . . . . 0.0 111.618 -175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.483 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 8.2 p80 -86.55 106.45 17.55 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.23 0.538 . . . . 0.0 112.218 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -91.55 166.31 12.9 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.1 p -142.72 140.58 31.54 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.902 -0.499 . . . . 0.0 112.163 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.03 157.58 34.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.942 176.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.62 -48.3 8.89 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 114.383 0.513 . . . . 0.0 114.383 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.02 -42.67 89.37 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.188 0.518 . . . . 0.0 111.516 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.88 -40.72 91.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.484 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.41 76.49 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.62 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.707 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 13.1 tm0? -56.58 -50.33 72.27 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -58.06 -56.79 17.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.16 0.505 . . . . 0.0 111.837 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 34.3 m -59.78 -31.24 69.5 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.026 0.441 . . . . 0.0 111.115 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' A' ' 107' ' ' PRO . . . -62.68 -45.2 93.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.103 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.517 ' HA ' HG13 ' A' ' 106' ' ' VAL . . . -66.0 -33.71 76.42 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.976 0.417 . . . . 0.0 111.855 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.7 -54.05 6.24 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -106.82 -40.7 5.42 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -169.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.2 m-85 -85.64 2.5 44.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.072 0.463 . . . . 0.0 112.186 -173.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.622 ' HA ' ' HD3' ' A' ' 107' ' ' PRO . 45.0 ptt85 -57.25 141.15 47.65 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.547 175.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.48 -17.81 22.58 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.063 -0.589 . . . . 0.0 113.928 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -87.55 97.45 10.86 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.282 0.563 . . . . 0.0 111.287 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.18 54.12 0.97 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.049 0.452 . . . . 0.0 111.894 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -158.8 36.37 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.42 0.628 . . . . 0.0 110.57 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -95.66 155.42 16.75 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.503 -173.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.1 t -123.75 130.27 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.328 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.1 tp -98.4 103.93 15.92 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.639 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.527 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 79.8 mt -86.89 113.9 23.08 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.51 124.45 40.5 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.926 0.393 . . . . 0.0 111.963 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.0 t -124.65 132.01 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 122.788 0.435 . . . . 0.0 110.887 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' A' ' 64' ' ' GLU . 38.7 mt-10 -79.4 66.1 4.76 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . 34.16 -78.41 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.1 mm-40 73.18 132.72 0.04 OUTLIER Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 123.705 0.802 . . . . 0.0 111.779 -170.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 64' ' ' GLU . 12.8 Cg_exo -70.38 26.16 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.574 2.85 . . . . 0.0 114.903 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.85 59.41 4.12 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.387 0.613 . . . . 0.0 111.756 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.455 ' HA2' ' O ' ' A' ' 70' ' ' LEU . . . -58.76 -11.49 10.99 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 115.751 -0.659 . . . . 0.0 114.062 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.81 -42.32 99.67 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.723 0.409 . . . . 0.0 111.831 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -105.61 -30.95 9.17 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' A' ' 82' ' ' PRO . 57.5 tp -104.7 101.8 11.41 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.954 0.407 . . . . 0.0 110.762 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -114.04 124.04 51.16 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -69.97 80.09 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.567 0.699 . . . . 0.0 109.132 171.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -100.5 137.39 38.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.236 -169.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.484 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -74.81 95.05 2.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.45 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 t -72.74 146.39 46.45 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.088 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 57.22 20.21 5.53 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.843 0.354 . . . . 0.0 111.886 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.03 42.3 99.66 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.351 -176.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.02 -99.69 0.32 Allowed Glycine 0 CA--C 1.531 1.059 0 C-N-CA 120.745 -0.741 . . . . 0.0 114.027 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.484 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -80.11 145.1 32.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -86.31 96.0 9.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.978 0.418 . . . . 0.0 111.6 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.7 129.14 39.19 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HB2' HD11 ' A' ' 70' ' ' LEU . 33.2 Cg_endo -64.76 100.34 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.515 2.143 . . . . 0.0 112.723 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -93.38 126.88 38.75 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.471 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 tp -92.5 116.05 28.64 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.402 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -84.22 22.32 1.24 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -149.77 156.92 38.64 Favored Pre-proline 0 CA--C 1.54 0.569 0 O-C-N 122.28 -0.262 . . . . 0.0 110.552 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.24 140.91 32.7 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.879 2.386 . . . . 0.0 113.852 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -89.45 98.1 11.58 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.079 0.466 . . . . 0.0 111.061 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.55 132.58 47.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.784 0.326 . . . . 0.0 110.754 176.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 98.2 t -59.7 -39.23 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 120.934 0.397 . . . . 0.0 111.302 -178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 64.1 m -68.33 -8.96 44.45 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -88.71 -28.17 20.73 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.031 0.444 . . . . 0.0 110.967 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.3 t -66.37 143.4 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.438 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.453 HG23 ' HG3' ' A' ' 95' ' ' ARG . 93.3 m -74.05 -65.08 0.88 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.723 0.297 . . . . 0.0 111.192 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.453 ' HG3' HG23 ' A' ' 94' ' ' THR . 37.3 mtp85 -148.15 159.55 43.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.143 0.496 . . . . 0.0 111.853 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -110.37 162.1 14.98 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.703 175.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.9 107.77 3.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.619 0.247 . . . . 0.0 111.474 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -60.2 120.1 9.14 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.011 0.434 . . . . 0.0 110.612 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.422 HD11 ' N ' ' A' ' 100' ' ' ASP . 2.8 tm? -111.27 132.88 54.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.196 -172.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.422 ' N ' HD11 ' A' ' 99' ' ' LEU . 4.2 t70 -124.26 -179.27 4.38 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 120.903 0.382 . . . . 0.0 111.499 -177.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.1 mt -94.66 165.76 12.35 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -173.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.566 ' HB3' ' HB2' ' A' ' 108' ' ' GLN . 5.7 p-10 -106.29 -162.99 0.89 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.109 0.481 . . . . 0.0 111.174 174.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.48 -30.59 68.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -89.72 -3.31 58.26 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.82 19.18 68.42 Favored Glycine 0 CA--C 1.525 0.685 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.956 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.517 HG13 ' HA ' ' A' ' 47' ' ' ALA . 74.2 t -99.8 137.76 20.24 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 122.862 0.465 . . . . 0.0 110.927 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.622 ' HD3' ' HA ' ' A' ' 51' ' ' ARG . 76.0 Cg_exo -51.66 101.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.152 1.901 . . . . 0.0 111.15 171.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' ' HB3' ' A' ' 102' ' ' ASP . 8.9 tp-100 -79.26 82.79 5.37 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -167.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.707 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 8.3 mp -83.98 -14.03 51.8 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.785 171.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.603 ' HA2' HD23 ' A' ' 115' ' ' LEU . . . -57.14 -41.5 92.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.891 176.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -83.21 -29.1 28.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 174.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . 0.469 ' HB3' ' HA ' ' A' ' 109' ' ' LEU . 75.8 t60 -76.11 -21.08 57.06 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.891 0.377 . . . . 0.0 111.817 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.552 ' HB2' HD12 ' A' ' 115' ' ' LEU . 72.7 mt -113.64 -171.77 1.95 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.151 0.5 . . . . 0.0 111.307 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -83.38 16.94 2.29 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -175.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.603 HD23 ' HA2' ' A' ' 110' ' ' GLY . 9.9 mp -64.57 -20.14 66.06 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 CA--C 1.54 0.585 0 CA-C-O 121.0 0.429 . . . . 0.0 110.975 174.639 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ttt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.704 0.287 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.528 ' O ' ' HA ' ' A' ' 62' ' ' GLU . 74.7 p -142.77 123.1 13.86 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.419 0.288 . . . . 0.0 110.849 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD12 ' HB3' ' A' ' 60' ' ' ALA . 3.8 mm? -83.5 122.86 29.11 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.254 0.549 . . . . 0.0 112.281 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 61' ' ' VAL . 15.6 pt -108.74 143.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.72 171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.505 ' HB3' HD12 ' A' ' 58' ' ' LEU . 40.0 m-85 -120.46 144.53 47.93 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -166.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -150.29 120.13 7.1 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.232 170.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 59.7 mt -92.49 129.74 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.942 0.401 . . . . 0.0 111.928 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -119.51 161.35 20.72 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.067 0.46 . . . . 0.0 111.731 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.5 p -83.51 142.48 30.87 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 166.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -52.22 -37.79 56.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.4 -42.95 67.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.39 -54.65 7.17 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.327 0.584 . . . . 0.0 111.626 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.473 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 50.0 t-105 -68.09 -32.59 73.02 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -64.88 -43.5 92.71 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.58 0.705 . . . . 0.0 110.124 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.26 81.83 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.01 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.67 -45.24 81.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.076 174.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.473 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.4 mttm -58.31 -39.21 78.77 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.011 0.434 . . . . 0.0 110.914 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.16 -30.25 71.33 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.141 0.496 . . . . 0.0 111.614 178.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -88.67 -28.02 20.87 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.817 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.42 -4.51 85.24 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.992 -170.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.598 ' HG3' HD22 ' A' ' 89' ' ' LEU . 46.1 ttp180 -146.16 141.56 27.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.462 0.305 . . . . 0.0 111.27 -178.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -103.73 141.4 36.15 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.137 0.494 . . . . 0.0 110.546 171.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -73.78 -165.27 0.27 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.58 -83.64 1.06 Allowed Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.375 -0.917 . . . . 0.0 111.675 172.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.0 t 163.96 163.31 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.473 1.109 . . . . 0.0 109.426 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.27 57.38 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.244 0.545 . . . . 0.0 110.642 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.0 t -72.72 -55.08 14.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.291 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -51.95 -46.09 64.61 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.95 0.405 . . . . 0.0 111.97 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.18 -25.33 60.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.28 86.15 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.147 0.498 . . . . 0.0 110.932 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.39 -39.81 74.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.293 0.568 . . . . 0.0 110.526 170.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.17 -4.51 18.27 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.681 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -165.6 163.05 19.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.824 0.345 . . . . 0.0 110.986 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -72.9 129.29 36.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.171 0.51 . . . . 0.0 111.399 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -124.14 106.71 10.55 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.121 0.486 . . . . 0.0 111.049 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.423 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 72.3 mt -86.54 175.29 8.41 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.173 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.5 p -128.58 153.63 47.03 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.985 0.421 . . . . 0.0 112.067 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.403 ' H ' ' CG ' ' A' ' 41' ' ' GLN . . . -98.36 -174.13 2.75 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.798 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -46.48 -66.12 1.87 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 114.943 0.737 . . . . 0.0 114.943 -173.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.29 -54.99 40.52 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 121.234 0.54 . . . . 0.0 111.926 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.403 ' CG ' ' H ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.99 -34.53 76.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.419 -177.21 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.98 -46.59 62.04 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.878 0.37 . . . . 0.0 111.093 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.404 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 8.3 tm0? -61.32 -41.82 97.65 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.2 -53.9 48.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 110.664 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.495 HG23 ' CD1' ' A' ' 49' ' ' TRP . 68.6 m -53.09 -38.68 62.78 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.934 0.397 . . . . 0.0 111.436 177.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.529 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -60.37 -39.01 85.69 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.58 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.08 -24.86 34.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.796 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.05 -64.79 1.11 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.149 0.5 . . . . 0.0 112.237 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.495 ' CD1' HG23 ' A' ' 45' ' ' THR . 52.9 m95 -91.65 -24.99 19.35 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' HA ' ' HG3' ' A' ' 53' ' ' GLN . 62.6 m-85 -108.1 17.6 22.13 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -73.09 115.6 12.61 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.81 29.67 54.12 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.135 -0.555 . . . . 0.0 114.154 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' HG3' ' HA ' ' A' ' 50' ' ' PHE . 83.5 mm-40 -88.38 -163.74 1.01 Allowed 'General case' 0 N--CA 1.473 0.716 0 O-C-N 122.446 -0.444 . . . . 0.0 111.586 177.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.32 136.08 31.19 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.526 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 55.25 81.31 0.11 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.0 mt -109.09 119.86 40.82 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.473 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.457 HG11 ' CD1' ' A' ' 13' ' ' TRP . 21.5 t -104.99 116.61 49.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 120.831 0.348 . . . . 0.0 111.182 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.505 HD12 ' HB3' ' A' ' 5' ' ' TYR . 63.4 tp -88.17 111.53 21.72 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.784 0.326 . . . . 0.0 111.18 178.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.8 mt -83.45 119.28 24.47 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.802 0.334 . . . . 0.0 110.836 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.489 ' HB3' HD12 ' A' ' 3' ' ' LEU . . . -116.02 96.25 5.49 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.108 0.48 . . . . 0.0 111.157 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.487 ' O ' HG12 ' A' ' 4' ' ' ILE . 36.5 t -106.08 139.27 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.528 ' HA ' ' O ' ' A' ' 2' ' ' THR . 24.5 mt-10 -89.81 127.21 35.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.974 -0.454 . . . . 0.0 110.512 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -36.37 -52.33 0.83 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 68.97 133.82 0.04 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 CA-C-O 120.868 0.366 . . . . 0.0 111.653 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.05 53.3 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 122.553 2.169 . . . . 0.0 112.888 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.09 -23.22 67.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.868 0.467 . . . . 0.0 112.201 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 139.48 -88.69 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.325 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -149.81 25.84 0.83 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 122.129 0.966 . . . . 0.0 109.928 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.56 -42.87 98.32 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.544 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.539 HD12 ' HB2' ' A' ' 82' ' ' PRO . 17.8 tp -100.25 105.8 17.4 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.049 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -103.56 107.88 18.92 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.901 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 71.7 m95 -73.54 112.53 9.71 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.811 0.338 . . . . 0.0 111.395 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.544 ' HB2' ' CE1' ' A' ' 83' ' ' HIS . 36.5 mt-10 -139.53 134.19 31.86 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.094 0.473 . . . . 0.0 111.065 -178.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.816 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -70.32 96.53 1.14 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.035 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m -69.41 -23.87 63.77 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.856 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -118.95 28.34 8.34 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.719 0.295 . . . . 0.0 111.411 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.24 -80.75 0.72 Allowed Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.974 -0.631 . . . . 0.0 113.393 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.92 49.04 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.911 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -85.25 121.6 28.23 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.575 -0.368 . . . . 0.0 111.679 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.816 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 63.3 mtm180 -85.73 149.55 25.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.005 0.431 . . . . 0.0 111.407 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -136.28 126.01 16.03 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.402 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.539 ' HB2' HD12 ' A' ' 70' ' ' LEU . 49.0 Cg_endo -68.78 111.94 2.75 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 122.4 2.067 . . . . 0.0 112.495 175.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.544 ' CE1' ' HB2' ' A' ' 73' ' ' GLU . 53.5 m170 -91.45 137.36 32.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.857 0.361 . . . . 0.0 111.789 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -117.17 118.82 33.36 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.844 0.354 . . . . 0.0 110.231 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -96.24 37.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 -164.3 155.13 13.31 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.336 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.519 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 18.2 Cg_endo -58.02 148.36 77.42 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.381 2.054 . . . . 0.0 112.92 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.81 103.39 15.95 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.101 0.476 . . . . 0.0 111.862 -172.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.598 HD22 ' HG3' ' A' ' 21' ' ' ARG . 73.8 mt -66.27 141.19 58.11 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.981 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.22 -36.21 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.274 0.559 . . . . 0.0 110.413 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.4 m -71.88 -0.23 10.79 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.938 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 4.9 tp10 -97.14 -17.43 19.92 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.202 0.525 . . . . 0.0 110.592 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.478 ' HA ' HG23 ' A' ' 61' ' ' VAL . 57.3 t -78.53 121.55 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.086 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.448 HG22 ' HG3' ' A' ' 62' ' ' GLU . 12.9 m -67.68 -56.42 9.41 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.826 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -139.8 162.62 34.7 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.064 0.459 . . . . 0.0 111.705 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.445 ' CD ' ' HZ2' ' A' ' 17' ' ' LYS . 12.5 pt-20 -150.37 158.64 44.38 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.5 177.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.47 122.37 3.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 104.91 6.66 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.91 0.386 . . . . 0.0 110.998 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.565 ' O ' HD21 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -131.42 91.82 3.07 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.321 1.057 . . . . 0.0 110.883 177.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -91.13 90.75 7.95 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.832 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.0 mt 62.65 -170.46 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 173.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -154.73 -164.98 1.94 Allowed 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.4 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.68 -29.81 28.59 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -98.85 4.13 47.46 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.133 -0.354 . . . . 0.0 111.887 -174.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 78.92 9.31 87.22 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.576 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.7 t -121.92 134.55 24.74 Favored Pre-proline 0 CA--C 1.54 0.581 0 O-C-N 122.596 -0.355 . . . . 0.0 110.809 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.529 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.8 Cg_endo -62.04 100.98 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 121.959 1.773 . . . . 0.0 112.192 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -70.27 78.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.208 0.528 . . . . 0.0 112.346 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.404 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 9.8 mp -65.45 -18.54 65.39 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 176.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.85 -36.37 41.53 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 121.265 -0.493 . . . . 0.0 113.504 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -79.85 -34.83 39.03 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.999 0.428 . . . . 0.0 111.542 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -83.3 -25.69 31.31 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -172.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 mt -91.45 -64.42 1.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.436 0.636 . . . . 0.0 111.135 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -161.53 124.99 3.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.061 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.7 mt -48.88 94.81 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -171.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.32 174.652 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.549 ' HE2' HD22 ' A' ' 3' ' ' LEU . 26.7 ttt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.677 0.275 . . . . 0.0 110.998 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.465 ' OG1' ' HB1' ' A' ' 63' ' ' ALA . 46.5 p -87.2 142.17 28.11 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 111.398 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.549 HD22 ' HE2' ' A' ' 1' ' ' MET . 88.0 mt -127.9 141.64 51.49 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.148 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.487 HG23 ' HB2' ' A' ' 63' ' ' ALA . 23.0 pt -110.66 139.31 34.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.897 0.379 . . . . 0.0 111.19 177.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.415 ' HB3' HD12 ' A' ' 58' ' ' LEU . 66.0 m-85 -122.13 136.2 54.88 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.922 0.391 . . . . 0.0 111.631 -175.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.479 ' HD2' ' HG ' ' A' ' 36' ' ' LEU . 57.3 tttp -138.9 113.42 8.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.001 0.429 . . . . 0.0 111.158 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.3 mt -85.31 140.13 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -161.07 160.71 30.79 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.68 0.276 . . . . 0.0 110.914 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 t -70.23 151.42 45.37 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.786 0.327 . . . . 0.0 111.173 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.05 -28.35 66.37 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.786 0.327 . . . . 0.0 110.322 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.95 99.11 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.234 175.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -67.73 -46.9 70.85 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.248 0.547 . . . . 0.0 110.715 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 30.6 t-105 -60.27 -49.7 76.56 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.467 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.72 -30.72 71.78 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.46 86.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.313 0.577 . . . . 0.0 110.984 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.28 66.86 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.18 0.514 . . . . 0.0 111.371 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.513 ' HA ' HG12 ' A' ' 90' ' ' VAL . 28.3 ttpp -67.3 -27.43 67.17 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.538 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -46.34 87.96 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.939 0.4 . . . . 0.0 111.272 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -84.14 -19.86 33.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.432 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.2 -0.35 63.9 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 121.365 -0.445 . . . . 0.0 113.623 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -140.33 138.3 34.8 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.272 0.558 . . . . 0.0 112.141 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -104.22 95.98 6.33 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.319 173.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -85.15 -1.93 57.45 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.219 0.533 . . . . 0.0 110.626 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.47 149.27 9.51 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.86 -0.609 . . . . 0.0 113.178 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.9 m -73.93 -179.56 3.79 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 122.626 -0.338 . . . . 0.0 110.294 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.91 -47.82 16.24 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -68.53 -55.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -54.74 -51.75 64.66 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.35 -36.76 83.22 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.53 -38.21 77.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.105 0.479 . . . . 0.0 111.472 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -78.49 -33.63 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.168 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.22 -5.92 84.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.241 -0.504 . . . . 0.0 112.207 -175.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.427 ' HD1' ' HA ' ' A' ' 85' ' ' TYR . 31.6 m-85 -124.49 111.93 16.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.473 0.309 . . . . 0.0 110.506 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.44 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 64.8 mt -62.32 113.25 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 120.967 0.413 . . . . 0.0 111.199 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -104.21 123.87 48.1 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 112.076 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.604 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 3.8 mp -110.48 166.7 10.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.206 -179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.3 m -111.05 116.5 31.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.864 0.364 . . . . 0.0 110.799 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.72 131.35 34.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -175.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.19 -127.81 42.47 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.041 0.776 . . . . 0.0 115.041 170.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.49 -19.21 65.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.84 0.352 . . . . 0.0 111.845 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.54 -29.02 66.51 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 110.716 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.8 -44.39 81.38 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.124 0.487 . . . . 0.0 110.817 175.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -61.32 -41.05 96.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.077 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 31.7 tt0 -60.7 -49.94 75.49 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.696 0.284 . . . . 0.0 110.624 174.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.0 m -57.24 -35.61 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.023 0.44 . . . . 0.0 110.933 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.18 88.16 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.0 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.41 -9.96 57.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 116.31 -0.405 . . . . 0.0 112.018 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 44' ' ' GLU . 33.9 mmtp -90.17 -61.18 1.74 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.101 0.477 . . . . 0.0 111.834 177.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -110.16 -40.12 4.8 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.469 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 99.9 m-85 -96.79 16.94 17.75 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -169.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.17 141.33 41.89 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.056 0.455 . . . . 0.0 111.8 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.14 23.17 65.86 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 114.461 0.545 . . . . 0.0 114.461 175.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.469 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 74.3 mt-30 -98.85 144.61 27.86 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.429 0.615 . . . . 0.0 111.424 177.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.28 142.25 27.82 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.4 81.31 0.18 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.048 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.2 mt -114.36 151.96 32.21 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.15 0.5 . . . . 0.0 111.75 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 49.5 t -130.46 142.81 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.783 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.9 tp -111.39 104.63 13.09 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.944 0.402 . . . . 0.0 110.648 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 93' ' ' VAL . 84.8 mt -79.9 108.38 13.43 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.913 0.387 . . . . 0.0 111.03 177.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.443 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -108.18 118.02 35.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.889 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.6 t -125.53 143.64 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.433 ' HA ' HD23 ' A' ' 3' ' ' LEU . 46.6 tt0 -72.53 125.36 27.24 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 110.839 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.487 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -82.01 37.61 0.49 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -176.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.81 117.23 39.83 Favored Pre-proline 0 CA--C 1.544 0.748 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -46.28 83.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.118 3.212 . . . . 0.0 114.596 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 mp -54.03 -56.26 19.63 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.687 0.755 . . . . 0.0 109.869 171.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.24 -136.71 2.05 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.834 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 37.8 tt0 -93.51 5.87 50.14 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.297 0.57 . . . . 0.0 111.139 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -81.2 -45.76 15.85 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 tp -81.13 103.07 10.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.989 0.423 . . . . 0.0 110.912 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.643 ' HE3' ' HB2' ' A' ' 73' ' ' GLU . 35.9 ttpt -114.01 117.61 31.81 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.827 0.346 . . . . 0.0 111.912 -177.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -71.57 98.17 1.83 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.096 0.474 . . . . 0.0 109.827 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.643 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -98.53 129.88 45.1 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.23 84.15 6.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.076 0.465 . . . . 0.0 110.021 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.5 m -61.08 106.54 0.61 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -176.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 66.32 -75.51 0.05 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.46 0.704 . . . . 0.0 111.807 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.26 -159.11 33.84 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.774 177.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.84 39.76 2.43 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.344 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.404 ' HB1' ' CE2' ' A' ' 81' ' ' PHE . . . -91.08 108.22 19.72 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.56 -0.377 . . . . 0.0 111.413 -177.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -75.58 92.74 2.94 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' CE2' ' HB1' ' A' ' 79' ' ' ALA . 65.5 m-85 -117.51 109.45 41.91 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 120.912 0.387 . . . . 0.0 111.91 177.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.604 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 55.2 Cg_endo -68.9 122.43 9.34 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.695 2.263 . . . . 0.0 112.515 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -115.19 120.35 39.44 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.41 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.44 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 16.2 mt -88.62 120.15 29.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.059 0.457 . . . . 0.0 111.7 176.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.427 ' HA ' ' HD1' ' A' ' 33' ' ' PHE . 4.4 m-85 -82.86 13.36 3.95 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.351 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -133.54 145.66 57.26 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.212 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -62.91 134.14 45.03 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.356 2.037 . . . . 0.0 111.845 171.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.3 tp -93.42 107.53 19.35 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.4 135.21 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.217 -0.302 . . . . 0.0 110.482 174.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.513 HG12 ' HA ' ' A' ' 17' ' ' LYS . 18.9 m -60.53 -30.36 46.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.96 0.409 . . . . 0.0 111.874 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -63.94 -18.02 63.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.598 176.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -90.57 -19.84 23.29 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.634 -177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.464 HG13 HD21 ' A' ' 59' ' ' LEU . 58.9 t -61.99 115.73 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 120.647 0.261 . . . . 0.0 110.998 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 27.9 m -53.36 -45.38 69.14 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -162.39 146.76 12.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.178 0.513 . . . . 0.0 112.021 174.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -101.78 95.47 6.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.535 0.683 . . . . 0.0 110.199 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.487 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -77.91 137.74 38.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.761 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -75.66 149.11 38.23 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.471 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.655 HD23 ' HB3' ' A' ' 107' ' ' PRO . 29.5 tp -140.07 133.24 29.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -123.77 171.12 9.87 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.296 0.57 . . . . 0.0 111.861 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.72 149.55 27.19 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.742 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -96.64 -161.4 0.87 Allowed 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.099 0.476 . . . . 0.0 111.41 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.15 -23.57 67.16 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -94.04 -9.99 34.95 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.139 -0.351 . . . . 0.0 111.544 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.01 22.01 60.12 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.242 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.1 t -100.5 130.27 26.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 O-C-N 122.722 -0.281 . . . . 0.0 111.134 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.655 ' HB3' HD23 ' A' ' 99' ' ' LEU . 45.8 Cg_exo -57.72 104.94 0.18 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.369 2.046 . . . . 0.0 112.212 174.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -75.51 100.18 4.45 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.49 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.4 mp -100.09 -19.91 16.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.074 176.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.4 -44.85 28.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.245 -176.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -72.0 -30.48 65.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -34.48 72.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 178.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 25.1 mt -72.08 161.05 31.46 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.171 0.51 . . . . 0.0 111.934 -175.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -85.79 -43.38 13.37 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 78.4 mt -77.25 164.71 25.34 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 N--CA 1.469 0.521 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.085 178.048 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.586 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.651 0.263 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.4 t -154.54 169.36 24.0 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 80.7 mt -122.23 134.53 54.7 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.929 -174.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.478 HD12 HD12 ' A' ' 36' ' ' LEU . 18.5 pt -121.63 142.44 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 121.02 0.438 . . . . 0.0 111.217 176.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -124.68 145.72 49.52 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.151 0.501 . . . . 0.0 112.263 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.675 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 58.6 tttm -135.27 126.94 29.03 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.052 171.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 64.4 mt -93.67 135.62 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.651 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.524 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 pt? -156.47 173.46 16.87 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.627 0.251 . . . . 0.0 110.948 177.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.6 p -77.62 150.74 34.61 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.709 0.29 . . . . 0.0 110.702 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -56.37 -39.36 72.79 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.133 0.492 . . . . 0.0 111.081 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.3 95.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.073 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.59 -44.37 96.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.147 0.498 . . . . 0.0 110.839 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.433 ' CH2' HG12 ' A' ' 90' ' ' VAL . 26.5 t-105 -63.78 -63.81 1.06 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.248 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -29.44 67.65 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.19 -47.51 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.145 0.497 . . . . 0.0 111.095 174.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.9 -30.29 65.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HA ' HG11 ' A' ' 90' ' ' VAL . 39.4 ttmt -56.11 -50.87 69.85 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.321 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.01 80.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.202 0.525 . . . . 0.0 111.358 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -72.44 -24.53 61.22 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.77 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.63 -11.59 13.34 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.261 -177.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -124.86 144.3 50.38 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.508 -0.407 . . . . 0.0 111.965 -176.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.675 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 63.3 t80 -149.19 111.18 4.6 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.067 0.46 . . . . 0.0 111.205 173.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.84 -4.0 44.5 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 122.181 -0.324 . . . . 0.0 111.84 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.63 -176.99 16.91 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.98 -0.628 . . . . 0.0 113.111 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.4 p -100.3 178.9 4.63 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.759 -0.26 . . . . 0.0 110.356 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.8 -27.79 19.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.137 0.494 . . . . 0.0 111.156 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -68.59 -52.93 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.094 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -58.79 -40.46 84.1 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.89 -26.71 67.75 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.476 175.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.31 -47.07 52.69 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.804 0.335 . . . . 0.0 111.218 175.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -64.74 -34.27 77.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.178 0.514 . . . . 0.0 111.406 174.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 93.57 10.67 58.95 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.077 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -164.18 147.99 9.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.0 mt -64.74 109.09 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.064 0.459 . . . . 0.0 110.482 176.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -74.97 87.67 2.33 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.343 0.592 . . . . 0.0 111.802 -177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.478 HD12 HD12 ' A' ' 4' ' ' ILE . 80.5 mt -84.52 173.46 10.81 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.345 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.436 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 69.0 m -148.69 144.63 27.25 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.947 0.403 . . . . 0.0 111.238 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.5 163.13 28.12 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.342 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -45.55 -47.89 12.32 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.385 -0.436 . . . . 0.0 113.799 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG3' ' HG3' ' A' ' 41' ' ' GLN . 8.1 pt-20 -52.15 -51.79 55.78 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 5.0 mt-30 -74.67 -32.44 62.22 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.981 0.419 . . . . 0.0 111.358 -175.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.45 -49.56 74.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.16 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.492 ' HB2' HD21 ' A' ' 109' ' ' LEU . 56.2 tt0 -67.3 -41.07 85.98 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.377 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.19 -51.91 67.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.965 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -56.37 -38.83 71.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.315 0.579 . . . . 0.0 110.779 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -67.68 -27.68 67.05 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.688 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.34 -41.12 18.59 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -78.53 -42.26 29.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -105.52 -58.18 1.93 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -171.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.506 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 95.5 m-85 -91.11 12.69 19.14 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.51 119.73 12.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.045 0.45 . . . . 0.0 112.19 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.68 -0.49 65.18 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.756 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.486 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 65.7 mt-30 -92.97 116.06 28.7 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 117.158 0.479 . . . . 0.0 111.194 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.34 39.79 1.11 Allowed 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -132.36 17.54 4.45 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.744 0.307 . . . . 0.0 111.195 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 50' ' ' PHE . 14.1 mt -94.54 124.54 38.64 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -171.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.412 ' O ' HD22 ' A' ' 8' ' ' LEU . 95.6 t -98.85 130.1 48.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.084 169.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.452 HD23 HD23 ' A' ' 99' ' ' LEU . 54.3 tp -97.87 109.37 22.14 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 110.672 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.9 mt -81.02 104.65 11.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.831 176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' A' ' 95' ' ' ARG . . . -94.55 93.81 7.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.155 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.732 HG22 HG12 ' A' ' 93' ' ' VAL . 22.3 t -112.26 138.18 42.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.966 -176.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.488 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 39.3 mt-10 -83.77 156.11 22.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.778 0.323 . . . . 0.0 110.304 173.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.38 59.8 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.914 0.388 . . . . 0.0 111.222 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.5 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 3.8 mm-40 -64.79 -51.42 57.77 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.975 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.5 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 89.3 Cg_exo -49.86 -56.13 3.43 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.613 2.209 . . . . 0.0 113.97 177.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.638 HD23 HD13 ' A' ' 84' ' ' LEU . 3.2 pp -81.84 -1.12 46.45 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -175.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.23 -155.5 47.55 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.055 -0.593 . . . . 0.0 113.827 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -94.27 14.11 21.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.9 -17.08 64.73 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.062 0.458 . . . . 0.0 111.033 175.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.8 tp -72.46 125.43 27.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.797 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -102.51 121.43 42.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.737 0.303 . . . . 0.0 111.385 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -89.04 131.42 35.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -137.3 103.28 5.05 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.166 0.508 . . . . 0.0 111.845 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HB3' ' HG2' ' A' ' 80' ' ' ARG . . . -82.47 79.34 8.94 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.053 0.454 . . . . 0.0 110.936 175.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.4 m -68.01 -21.07 65.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.031 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.6 143.52 50.97 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.659 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -51.74 105.14 0.2 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.497 -0.383 . . . . 0.0 113.558 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.83 -30.9 9.37 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.348 -0.454 . . . . 0.0 113.423 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -91.05 99.11 12.2 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.209 0.528 . . . . 0.0 111.674 -177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.437 ' HG2' ' HB3' ' A' ' 74' ' ' ALA . 20.2 mtm180 -91.01 101.26 14.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.532 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -90.86 114.81 62.67 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -173.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.84 131.33 12.13 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.528 2.152 . . . . 0.0 112.432 174.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -127.23 129.12 47.17 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.638 HD13 HD23 ' A' ' 66' ' ' LEU . 7.1 mt -106.09 111.57 24.25 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.412 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -83.53 10.78 8.21 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.725 0.298 . . . . 0.0 111.637 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -137.77 147.61 57.62 Favored Pre-proline 0 N--CA 1.472 0.638 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.72 135.16 65.3 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.883 2.389 . . . . 0.0 113.519 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.0 tp -94.39 131.75 39.73 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -89.56 136.15 33.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.759 0.314 . . . . 0.0 110.817 177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.515 HG11 ' HA ' ' A' ' 17' ' ' LYS . 95.2 t -57.4 -34.37 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 121.263 0.554 . . . . 0.0 110.83 176.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 59.1 p -67.72 -13.49 62.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.945 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -90.4 -21.42 21.96 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 120.901 0.381 . . . . 0.0 111.396 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.732 HG12 HG22 ' A' ' 61' ' ' VAL . 85.4 t -64.79 145.31 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 72.1 m -85.47 -68.68 0.71 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.509 ' HB3' ' HB1' ' A' ' 60' ' ' ALA . 74.3 ttt180 -126.17 146.75 49.83 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -110.28 124.78 52.26 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.048 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -139.96 108.19 5.79 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.02 128.96 38.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.818 0.342 . . . . 0.0 110.26 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.452 HD23 HD23 ' A' ' 58' ' ' LEU . 86.8 mt -78.19 90.63 4.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -174.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -78.49 99.94 6.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.156 0.503 . . . . 0.0 110.493 170.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.74 150.82 28.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.189 0.519 . . . . 0.0 111.928 -178.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -138.38 171.22 14.7 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.906 -170.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.56 -83.5 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 177.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -90.65 -11.75 38.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.042 0.448 . . . . 0.0 111.267 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.15 26.68 33.16 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.478 -175.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.73 126.21 36.2 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 122.356 0.262 . . . . 0.0 110.908 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.16 140.56 49.66 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.406 2.071 . . . . 0.0 112.853 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -84.11 87.77 7.16 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.347 0.594 . . . . 0.0 112.208 -175.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.492 HD21 ' HB2' ' A' ' 43' ' ' GLN . 11.1 mp -93.96 -4.53 49.57 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.973 -0.454 . . . . 0.0 112.163 176.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.45 74.8 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.611 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 -28.93 61.36 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.324 0.583 . . . . 0.0 111.166 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -72.71 -46.08 55.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.132 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.9 mt -85.25 171.49 11.89 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -78.78 106.73 10.98 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.051 0.453 . . . . 0.0 111.632 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.8 tp -92.01 -40.55 11.03 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.812 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -173.548 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m -87.09 96.19 10.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -171.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.12 119.3 31.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.679 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' HB ' HD12 ' A' ' 36' ' ' LEU . 26.6 pt -93.69 146.45 6.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 110.85 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.505 ' HB3' HD12 ' A' ' 58' ' ' LEU . 89.0 m-85 -126.14 133.67 51.54 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.121 0.486 . . . . 0.0 112.192 -174.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' HZ2' HD13 ' A' ' 8' ' ' LEU . 47.0 tttm -130.5 117.27 19.37 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.907 174.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pp -84.3 139.37 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.901 0.381 . . . . 0.0 111.21 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD13 ' HZ2' ' A' ' 6' ' ' LYS . 2.2 pt? -165.96 156.47 12.93 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.933 0.397 . . . . 0.0 111.682 177.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.9 m -69.83 140.1 53.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.613 175.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -49.98 -38.34 36.51 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.24 -46.32 62.29 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 176.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.9 -43.87 82.27 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.799 0.333 . . . . 0.0 111.177 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.53 ' CH2' HG22 ' A' ' 90' ' ' VAL . 28.1 t-105 -63.08 -53.14 58.33 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -28.5 69.72 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 122.394 -0.191 . . . . 0.0 111.485 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.68 -52.27 63.95 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.071 0.462 . . . . 0.0 110.777 173.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.97 78.79 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.141 0.496 . . . . 0.0 111.14 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -66.33 -38.03 86.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.11 84.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.172 0.51 . . . . 0.0 110.831 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -71.41 -27.95 63.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.428 0.633 . . . . 0.0 110.613 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.15 4.58 89.79 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.938 -173.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.548 ' HB2' HD13 ' A' ' 89' ' ' LEU . 36.1 ttt180 -154.47 139.29 17.14 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -173.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.494 ' CZ ' ' HE3' ' A' ' 6' ' ' LYS . 83.8 t80 -122.44 140.31 52.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -154.85 74.34 0.92 Allowed 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.695 0.759 . . . . 0.0 111.763 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.26 117.17 1.14 Allowed Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.844 -0.616 . . . . 0.0 113.458 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.438 ' N ' ' HB2' ' A' ' 28' ' ' ASP . 70.1 m -70.43 -179.94 2.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 122.638 -0.331 . . . . 0.0 110.842 175.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -46.22 -49.9 16.54 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.211 0.529 . . . . 0.0 111.794 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.8 t -70.68 -51.74 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.438 ' HB2' ' N ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -54.83 -53.17 58.77 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.839 0.456 . . . . 0.0 112.193 -178.144 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 45.8 tp -62.48 -36.64 83.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.949 0.404 . . . . 0.0 111.125 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -18.29 61.03 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.906 0.384 . . . . 0.0 111.888 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.03 -47.2 7.99 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.878 0.371 . . . . 0.0 111.573 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 150.0 -40.74 0.84 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.217 -0.516 . . . . 0.0 112.825 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -150.56 178.49 9.02 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.706 0.289 . . . . 0.0 111.199 -177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -85.83 125.04 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-O 121.011 0.434 . . . . 0.0 111.549 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -107.65 90.88 3.43 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.375 0.607 . . . . 0.0 111.334 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.607 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 80.9 mt -79.55 170.78 16.06 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.194 0.521 . . . . 0.0 111.805 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -132.23 119.37 20.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.63 101.81 8.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.68 -91.85 0.01 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.489 0.556 . . . . 0.0 114.489 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -45.95 -54.95 7.45 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.025 0.53 . . . . 0.0 111.699 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -63.73 -25.03 68.01 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.732 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.18 -54.6 9.19 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.635 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.52 HE21 ' HB2' ' A' ' 108' ' ' GLN . 52.6 tt0 -67.92 -30.81 70.22 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.684 0.278 . . . . 0.0 111.672 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.25 -46.46 77.04 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.627 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.1 m -60.38 -38.58 84.36 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.063 0.459 . . . . 0.0 110.837 175.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.316 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -77.23 -25.67 51.86 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.928 0.394 . . . . 0.0 111.567 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -82.42 -70.62 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.164 0.507 . . . . 0.0 112.237 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -88.02 -32.64 18.7 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.518 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 88.0 m-85 -101.13 14.36 32.22 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 2.4 tmt_? -58.39 101.91 0.1 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.356 0.598 . . . . 0.0 111.429 -177.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.69 21.72 30.55 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.294 176.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.518 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 76.5 mt-30 -90.94 -179.28 5.44 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.425 0.613 . . . . 0.0 111.438 173.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.5 160.03 35.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -176.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.416 ' N ' HD21 ' A' ' 55' ' ' ASN . 0.9 OUTLIER 61.98 31.07 18.14 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.287 178.002 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.3 mt -76.85 98.32 4.83 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.453 0.644 . . . . 0.0 111.207 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.447 ' O ' HD22 ' A' ' 8' ' ' LEU . 61.0 t -83.7 125.78 40.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.804 176.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HB3' ' HB1' ' A' ' 97' ' ' ALA . 55.2 tp -94.01 101.62 13.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 174.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 91.5 mt -75.17 109.64 8.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.695 0.283 . . . . 0.0 111.194 178.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.27 114.45 28.74 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.563 176.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 93' ' ' VAL . 43.4 t -126.71 127.99 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.53 90.98 2.25 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.519 0.676 . . . . 0.0 111.16 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.69 42.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.307 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 65.7 158.89 0.13 Allowed Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.579 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.9 76.55 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.902 2.401 . . . . 0.0 112.918 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.4 mt -66.98 -65.23 0.71 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.72 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 145.46 -90.65 0.15 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 120.544 -0.836 . . . . 0.0 114.017 177.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -85.02 -42.57 14.74 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -173.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.414 ' HB2' ' HG2' ' A' ' 86' ' ' ARG . 24.7 p-10 -75.45 -41.97 54.43 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 111.805 -173.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.5 tp -85.96 96.49 9.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.219 0.533 . . . . 0.0 109.83 170.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.419 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 25.5 tptp -107.54 101.97 11.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.492 -171.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -78.27 103.3 8.12 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.419 ' HG3' ' HG3' ' A' ' 71' ' ' LYS . 45.3 mt-10 -119.56 107.33 13.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.939 0.4 . . . . 0.0 111.707 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.647 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -77.16 133.57 38.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.345 175.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.1 m -69.3 173.21 5.97 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -51.39 90.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.543 0.687 . . . . 0.0 112.727 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 15.04 60.74 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.767 0.667 . . . . 0.0 114.767 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 165.66 167.74 26.75 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 119.795 -1.193 . . . . 0.0 114.958 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.406 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 61.36 97.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.907 0.883 . . . . 0.0 113.332 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.647 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 8.7 ptp180 -86.92 103.13 15.01 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.237 0.542 . . . . 0.0 111.199 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -90.28 120.6 69.1 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.002 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 20.3 Cg_exo -66.31 96.99 0.35 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.677 2.251 . . . . 0.0 111.959 173.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -90.53 112.9 24.75 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.952 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -104.95 123.36 47.63 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.254 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -105.36 30.8 5.37 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.54 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.414 ' HG2' ' HB2' ' A' ' 69' ' ' ASP . 16.7 mmt85 -132.17 148.68 70.74 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 122.35 0.26 . . . . 0.0 111.554 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.85 123.25 7.82 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.562 2.175 . . . . 0.0 112.283 174.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 tp -90.55 108.53 19.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.008 0.432 . . . . 0.0 111.537 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.548 HD13 ' HB2' ' A' ' 21' ' ' ARG . 4.1 mm? -69.26 142.34 54.17 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.74 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.53 HG22 ' CH2' ' A' ' 13' ' ' TRP . 4.4 p -57.08 -30.98 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.438 0.637 . . . . 0.0 110.942 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.2 t -62.92 -28.08 69.81 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.286 178.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 10.0 mm-40 -87.13 -2.81 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.443 ' HA ' HG22 ' A' ' 61' ' ' VAL . 92.5 t -77.82 128.15 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 120.813 0.34 . . . . 0.0 111.412 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 28.7 m -70.5 -61.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.812 0.339 . . . . 0.0 111.377 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 95' ' ' ARG . 24.0 ttt85 -148.5 145.76 28.06 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.28 0.562 . . . . 0.0 111.924 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -111.2 105.58 14.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.874 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.517 ' HB1' ' HB3' ' A' ' 58' ' ' LEU . . . -87.67 90.25 8.3 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.941 -0.474 . . . . 0.0 111.837 -178.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -71.92 110.09 6.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.896 0.379 . . . . 0.0 111.004 177.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.9 mt -130.64 106.05 8.23 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -72.1 139.87 48.6 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 166.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.538 HD11 ' O ' ' A' ' 105' ' ' GLY . 83.7 mt -78.96 160.29 27.3 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -152.51 165.74 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 63.42 -84.95 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.484 0.713 . . . . 0.0 112.028 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -106.07 -22.63 12.83 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.873 0.844 . . . . 0.0 109.619 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.538 ' O ' HD11 ' A' ' 101' ' ' LEU . . . 120.25 15.05 5.22 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.296 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.558 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 39.8 t -137.32 75.13 46.69 Favored Pre-proline 0 CA--C 1.547 0.862 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -83.56 -73.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.482 2.121 . . . . 0.0 109.413 160.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.558 ' NE2' ' HA ' ' A' ' 106' ' ' VAL . 75.3 mt-30 56.07 -147.05 0.54 Allowed 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 161.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.462 HD12 ' N ' ' A' ' 109' ' ' LEU . 6.3 mp -64.78 5.65 0.3 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.97 -24.32 13.86 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.645 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -98.69 -28.61 13.45 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 120.993 0.425 . . . . 0.0 111.304 175.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -69.85 -36.77 75.81 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.446 ' HG ' ' HB3' ' A' ' 109' ' ' LEU . 52.8 mt -104.97 166.16 10.57 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.894 0.378 . . . . 0.0 111.719 -175.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 63.83 24.91 13.91 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.277 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.641 HD22 ' H ' ' A' ' 115' ' ' LEU . 1.9 pt? -71.27 75.13 0.72 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.867 0.841 . . . . 0.0 111.853 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 N--CA 1.466 0.33 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.525 175.89 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.876 0.369 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m -87.97 106.3 18.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.879 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.45 116.28 22.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.003 0.43 . . . . 0.0 111.526 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 17.4 pt -105.77 129.23 59.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.196 0.522 . . . . 0.0 110.55 173.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.488 ' HB3' HD12 ' A' ' 58' ' ' LEU . 6.6 m-85 -110.75 159.22 17.83 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -168.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HZ2' ' HB3' ' A' ' 6' ' ' LYS . 6.8 ttpm? -162.11 136.65 6.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.089 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -96.67 141.2 15.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.166 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -153.64 162.66 41.05 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.649 0.261 . . . . 0.0 110.812 174.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -73.69 149.34 41.97 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 19.5 mmm-85 -53.65 -40.44 65.86 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.319 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -23.9 59.95 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 111.831 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -89.32 -48.2 7.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 110.526 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 26.3 t-105 -65.17 -55.59 17.71 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.076 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -33.82 68.57 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.31 98.79 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.053 0.454 . . . . 0.0 110.617 173.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.66 93.85 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.414 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.523 ' HA ' HG22 ' A' ' 90' ' ' VAL . 52.6 mtmt -63.66 -38.3 90.61 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.514 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.26 -40.99 78.8 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.158 0.504 . . . . 0.0 111.139 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -95.89 1.01 52.73 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.826 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.53 5.03 41.85 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 114.22 0.448 . . . . 0.0 114.22 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.436 ' HG2' ' CD2' ' A' ' 89' ' ' LEU . 60.4 mtt85 -138.22 130.92 29.48 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.899 -0.765 . . . . 0.0 112.255 -175.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -95.25 111.38 23.24 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -102.81 -10.96 18.66 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -172.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.08 167.82 42.01 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.15 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.2 p -90.39 172.22 8.9 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 122.335 -0.509 . . . . 0.0 111.464 -177.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.37 -32.77 62.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.286 176.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.7 t -63.09 -45.06 99.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.069 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.491 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 7.7 m-20 -56.29 -51.45 68.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.906 0.384 . . . . 0.0 111.125 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.84 -35.48 80.1 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.997 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -35.36 72.2 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.136 0.494 . . . . 0.0 112.067 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.496 ' HB3' ' CE1' ' A' ' 35' ' ' HIS . 12.2 t70 -84.24 -55.65 4.07 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.397 -178.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.34 60.35 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 121.223 -0.513 . . . . 0.0 112.696 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.499 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 80.3 m-85 64.39 -171.91 0.18 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.508 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 65.8 mt -55.55 125.46 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -173.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.496 ' CE1' ' HB3' ' A' ' 31' ' ' ASP . 0.7 OUTLIER -87.68 146.59 25.63 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.823 178.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.543 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 5.1 mp -142.17 175.67 9.57 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.511 0.325 . . . . 0.0 110.156 167.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.5 m -140.52 159.55 41.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.043 0.449 . . . . 0.0 112.167 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.58 -174.35 3.81 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.531 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -51.36 -72.89 0.44 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.503 -0.379 . . . . 0.0 113.994 -177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -65.78 -32.45 73.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.027 0.442 . . . . 0.0 110.974 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -63.74 -29.51 70.71 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.03 -44.21 93.22 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.063 0.458 . . . . 0.0 110.917 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -66.71 -34.76 78.55 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.92 -52.08 66.58 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.101 0.477 . . . . 0.0 110.492 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 29.4 m -57.77 -38.96 76.36 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.017 0.437 . . . . 0.0 110.938 176.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.51 -50.07 68.83 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.882 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.04 -22.25 66.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -99.94 -43.23 6.46 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -109.78 -19.51 13.12 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -170.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.512 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 92.7 m-85 -131.81 28.48 4.54 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 122.021 -0.425 . . . . 0.0 112.041 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -71.62 119.12 15.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.849 0.357 . . . . 0.0 111.882 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.5 61.09 4.32 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-N 116.199 -0.455 . . . . 0.0 113.703 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.531 ' HB2' HD11 ' A' ' 56' ' ' LEU . 49.8 mt-30 -140.98 159.95 41.11 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 111.662 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.43 175.2 5.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.341 177.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 47.3 m-80 61.26 30.23 19.08 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.166 0.508 . . . . 0.0 111.172 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 53' ' ' GLN . 84.9 mt -92.96 127.23 38.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.39 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.51 122.54 60.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.815 0.34 . . . . 0.0 111.109 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.658 ' HB2' HD22 ' A' ' 99' ' ' LEU . 43.7 tp -88.1 98.09 11.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.849 0.357 . . . . 0.0 110.253 174.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 93.9 mt -74.18 107.27 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.823 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.49 100.74 10.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.627 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 95.9 t -109.08 131.62 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.038 0.447 . . . . 0.0 112.155 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -73.55 123.18 23.46 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.779 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.17 -52.2 64.78 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.543 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 1.8 mp0 -59.98 -48.75 93.92 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.543 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 38.1 Cg_exo -62.95 -16.11 52.01 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.153 1.902 . . . . 0.0 113.716 176.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tt -64.79 -65.83 0.62 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.0 -137.04 5.97 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.659 -0.781 . . . . 0.0 114.058 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -103.68 -21.63 13.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -172.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -78.86 30.49 0.2 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -169.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.439 HD11 ' HB3' ' A' ' 82' ' ' PRO . 58.6 tp -112.02 140.41 46.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.024 0.44 . . . . 0.0 111.748 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -150.86 128.12 11.27 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.358 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.568 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 76.6 m95 -76.98 86.05 3.5 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.416 0.626 . . . . 0.0 110.504 175.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.2 119.42 33.68 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.468 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.98 64.43 2.46 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.228 0.537 . . . . 0.0 110.89 176.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.9 p -77.74 74.15 4.3 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.07 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.438 HH11 ' HB2' ' A' ' 76' ' ' ARG . 3.1 mtm105 67.32 161.23 0.17 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.31 -63.36 3.97 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.19 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.63 150.09 5.2 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.193 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 68.06 -169.75 0.19 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.857 0.463 . . . . 0.0 111.791 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.568 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 4.4 mpt_? -104.86 122.67 46.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.241 0.543 . . . . 0.0 112.157 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -99.72 110.51 59.16 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.027 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.543 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 51.9 Cg_exo -55.89 111.43 0.77 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.668 2.245 . . . . 0.0 113.17 175.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -97.03 132.46 42.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.031 174.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.508 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 59.1 tp -107.91 111.7 23.94 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.937 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.14 30.04 0.28 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -173.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -160.35 154.13 19.19 Favored Pre-proline 0 N--CA 1.471 0.579 0 O-C-N 122.164 -0.335 . . . . 0.0 111.418 177.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.91 118.39 5.26 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.498 2.132 . . . . 0.0 112.331 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.6 tp -72.72 100.61 2.88 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.102 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.436 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 55.1 mt -58.9 130.06 45.16 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.506 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.523 HG22 ' HA ' ' A' ' 17' ' ' LYS . 96.0 t -56.54 -34.42 41.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 110.876 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.8 p -62.51 -26.75 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.88 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -87.11 -18.49 30.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -64.11 116.24 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.981 0.42 . . . . 0.0 111.254 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.627 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 51.0 p -70.99 -46.5 62.17 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -144.67 145.02 31.54 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -135.39 136.59 41.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.079 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.29 119.63 10.24 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.45 139.14 53.96 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.896 0.379 . . . . 0.0 110.808 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.658 HD22 ' HB2' ' A' ' 58' ' ' LEU . 3.5 mm? -89.02 105.9 18.08 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.54 90.64 6.79 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 168.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.712 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 70.9 mt -89.37 156.52 18.65 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -171.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -144.2 166.25 25.58 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.724 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 54.75 -86.41 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.498 0.719 . . . . 0.0 112.9 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -97.29 -7.36 32.28 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.441 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.712 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 69.63 43.73 66.74 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.609 -175.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.763 ' H ' ' HD2' ' A' ' 107' ' ' PRO . 71.4 t -156.08 -57.85 0.02 OUTLIER Pre-proline 0 N--CA 1.485 1.323 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.763 ' HD2' ' H ' ' A' ' 106' ' ' VAL . 7.4 Cg_endo -40.69 -74.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 124.462 3.442 . . . . 0.0 116.074 -164.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.579 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.3 OUTLIER -48.69 71.5 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -172.084 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 107' ' ' PRO . 1.3 tp -102.06 -31.06 10.81 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.777 -0.577 . . . . 0.0 111.842 170.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.21 -47.1 34.42 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.05 -26.76 68.99 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.837 0.351 . . . . 0.0 111.658 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -82.25 -28.59 31.76 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.907 0.384 . . . . 0.0 110.965 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 41.0 mt -72.32 -70.16 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 113' ' ' LEU . . . 173.87 -82.13 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.069 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.0 mt 55.4 25.18 7.36 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 . . . . . 0 N--CA 1.475 0.811 0 CA-C-O 121.296 0.57 . . . . 0.0 112.249 179.507 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.488 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.75 0.31 . . . . 0.0 111.607 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.7 p -123.92 138.12 54.52 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.281 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.485 HD22 ' HB3' ' A' ' 60' ' ' ALA . 2.3 tt -118.11 124.57 48.36 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 -173.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 28.9 pt -96.58 148.33 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.008 0.433 . . . . 0.0 111.219 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.448 ' HB3' HD11 ' A' ' 58' ' ' LEU . 88.2 m-85 -126.79 103.15 7.37 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -172.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.777 ' HZ3' ' HB3' ' A' ' 8' ' ' LEU . 23.2 tptp -89.97 109.5 20.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.832 0.348 . . . . 0.0 111.208 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.1 mt -88.86 137.01 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.214 175.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.777 ' HB3' ' HZ3' ' A' ' 6' ' ' LYS . 1.7 pt? -166.11 171.13 12.71 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.992 0.425 . . . . 0.0 112.144 -177.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -80.95 148.12 29.96 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.74 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -58.13 -37.08 73.91 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.6 -21.94 65.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.758 0.313 . . . . 0.0 111.736 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -79.24 -51.71 9.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.532 0.682 . . . . 0.0 109.966 175.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.461 ' HB2' HD12 ' A' ' 8' ' ' LEU . 8.1 t-105 -64.01 -61.58 2.18 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.154 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.452 ' HA ' ' HB3' ' A' ' 17' ' ' LYS . 7.0 m-20 -60.69 -26.35 67.06 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.2 -44.45 83.87 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.127 0.489 . . . . 0.0 110.455 172.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.81 63.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.023 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.528 ' HA ' HG22 ' A' ' 90' ' ' VAL . 39.1 ttmt -66.02 -42.88 89.05 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.405 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.94 95.18 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.233 0.539 . . . . 0.0 110.753 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.91 -28.46 68.95 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.387 173.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.46 9.58 81.83 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.088 -171.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -150.93 112.25 4.38 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 122.609 -0.348 . . . . 0.0 111.673 -173.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.492 ' HB3' ' HB3' ' A' ' 88' ' ' LEU . 69.4 t80 -89.8 109.2 20.21 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.992 0.425 . . . . 0.0 110.688 175.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -93.97 -7.84 41.75 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.123 0.487 . . . . 0.0 111.129 -178.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.88 -177.7 19.39 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.922 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -104.63 -174.79 2.62 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 122.722 -0.281 . . . . 0.0 110.456 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.38 -43.79 61.99 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.98 0.419 . . . . 0.0 111.876 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.6 -40.85 82.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.865 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.61 -46.0 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.022 0.439 . . . . 0.0 110.919 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.51 -34.03 77.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.277 175.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.99 -44.02 97.61 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 111.027 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -69.48 -32.54 71.5 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.952 0.406 . . . . 0.0 111.136 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.31 -11.51 51.27 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.462 -0.399 . . . . 0.0 112.626 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -153.08 155.09 36.16 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.672 0.389 . . . . 0.0 110.731 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.0 mt -73.23 141.75 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.485 0.659 . . . . 0.0 112.233 -172.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -133.34 100.06 4.72 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.677 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.462 ' N ' HD13 ' A' ' 36' ' ' LEU . 4.8 mp -82.14 -32.74 29.93 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -171.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.2 m 73.22 165.14 0.29 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.885 0.474 . . . . 0.0 111.178 -174.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.37 131.26 20.32 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.08 -104.46 0.07 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 115.184 0.834 . . . . 0.0 115.184 171.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -48.59 -45.32 37.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.192 0.597 . . . . 0.0 111.67 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -68.33 -38.52 81.6 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.54 65.8 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.672 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.0 -39.19 94.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.87 -52.29 57.35 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.22 0.533 . . . . 0.0 110.593 177.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 m -58.68 -33.02 69.67 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.176 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.21 -48.55 81.0 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.778 0.323 . . . . 0.0 111.108 175.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -39.67 93.01 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.882 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -71.96 -43.79 64.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.994 0.426 . . . . 0.0 111.95 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -109.42 -66.05 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -172.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.403 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 98.8 m-85 -76.23 -8.1 56.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -163.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -63.31 2.16 0.42 Allowed 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -173.412 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -149.07 40.05 0.91 Allowed Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.403 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 1.6 mp0 -122.67 174.9 6.81 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.18 0.514 . . . . 0.0 111.67 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.26 161.49 17.14 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.276 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 59.8 36.8 22.12 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.206 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 89.2 mt -74.56 128.66 36.11 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.166 0.508 . . . . 0.0 111.904 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.2 t -121.86 145.83 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.892 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.448 HD11 ' HB3' ' A' ' 5' ' ' TYR . 47.2 tp -114.95 102.25 9.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.15 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 6' ' ' LYS . 90.4 mt -84.68 117.46 23.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.856 0.36 . . . . 0.0 111.414 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.485 ' HB3' HD22 ' A' ' 3' ' ' LEU . . . -102.88 115.83 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.116 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 50.2 t -126.08 137.32 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 111.657 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -77.83 130.99 37.35 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.753 0.311 . . . . 0.0 110.62 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.61 -28.37 28.53 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.574 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 7.0 mp0 -63.82 -46.99 82.1 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -174.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.574 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 7.8 Cg_endo -49.04 -66.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.532 2.155 . . . . 0.0 113.796 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.84 -26.97 67.73 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 58.81 -108.67 1.65 Allowed Glycine 0 CA--C 1.533 1.18 0 N-CA-C 115.104 0.802 . . . . 0.0 115.104 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.9 -27.74 66.97 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -170.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.423 ' HB3' ' HG2' ' A' ' 86' ' ' ARG . 79.0 m-20 -73.56 -7.16 50.77 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.1 tp -120.34 117.51 27.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.71 0.291 . . . . 0.0 110.245 174.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -133.45 134.05 43.08 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.14 0.495 . . . . 0.0 112.162 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -81.24 86.89 6.15 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.668 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -75.39 126.22 30.58 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.92 127.68 33.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.988 0.423 . . . . 0.0 111.358 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 87.3 p -74.11 176.64 6.37 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.396 0.617 . . . . 0.0 112.244 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -65.87 -30.05 70.59 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.972 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.96 14.27 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.779 176.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.55 -49.08 0.53 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.616 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.01 142.28 51.67 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -87.28 150.23 24.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.0 0.429 . . . . 0.0 111.728 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -130.48 124.74 21.25 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.268 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.98 99.5 0.4 Allowed 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.514 2.142 . . . . 0.0 112.357 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -98.25 125.13 43.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.447 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.1 tp -95.46 113.75 25.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.679 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -87.6 22.67 2.17 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.245 0.545 . . . . 0.0 111.824 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.423 ' HG2' ' HB3' ' A' ' 69' ' ' ASP . 31.3 mmt180 -131.97 140.6 38.67 Favored Pre-proline 0 N--CA 1.468 0.44 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.678 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -59.28 118.0 4.82 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 121.921 1.747 . . . . 0.0 110.987 170.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.492 ' HB3' ' HB3' ' A' ' 22' ' ' PHE . 56.4 tp -67.12 87.78 0.16 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.437 0.637 . . . . 0.0 111.578 -172.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.5 mt -60.22 134.18 56.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 17' ' ' LYS . 79.3 t -60.09 -31.77 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 121.201 0.524 . . . . 0.0 110.695 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.1 m -71.04 -11.94 61.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.481 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.6 -13.79 22.65 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.955 0.407 . . . . 0.0 111.141 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t -76.53 137.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.861 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.668 HG21 ' HG3' ' A' ' 95' ' ' ARG . 22.8 m -76.3 -66.3 0.82 Allowed 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.668 ' HG3' HG21 ' A' ' 94' ' ' THR . 62.1 mtt85 -141.92 152.79 43.87 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.17 125.35 47.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.045 0.45 . . . . 0.0 109.959 171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.42 155.73 30.24 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.3 0.571 . . . . 0.0 112.537 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -98.7 96.1 7.69 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 1.8 pt? -79.24 149.19 31.95 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.334 0.588 . . . . 0.0 112.26 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -86.53 174.35 9.0 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.844 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.695 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 75.1 mt -133.91 86.51 2.29 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.688 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.629 ' HB3' HE21 ' A' ' 108' ' ' GLN . 24.5 t70 -90.3 166.19 13.46 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -174.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.14 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -135.01 26.95 3.57 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.341 0.591 . . . . 0.0 110.44 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.695 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 102.36 22.34 9.87 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.71 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.8 t -98.02 112.65 62.37 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 122.495 -0.415 . . . . 0.0 110.844 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.39 121.94 10.7 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.674 2.249 . . . . 0.0 112.85 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.629 HE21 ' HB3' ' A' ' 102' ' ' ASP . 87.0 mm-40 -74.59 75.82 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.523 0.677 . . . . 0.0 111.645 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.604 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.9 mp -73.23 -16.08 61.41 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.946 177.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.95 -36.48 51.16 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.039 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -71.58 -22.58 61.71 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.969 0.414 . . . . 0.0 111.498 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -90.6 -14.38 32.55 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 18.2 mt -98.32 -161.15 0.85 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.106 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 76.82 -49.84 0.56 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.292 0.637 . . . . 0.0 112.101 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 tt 73.37 -61.89 0.49 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.44 0.696 . . . . 0.0 111.229 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 179.449 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.461 ' H1 ' ' HA ' ' A' ' 64' ' ' GLU . 66.9 mtt . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 111.055 0.02 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.5 t 48.99 -177.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.2 mt -125.49 144.82 50.37 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.416 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.605 HG21 HD11 ' A' ' 70' ' ' LEU . 17.5 pt -118.71 139.88 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-O 121.158 0.504 . . . . 0.0 111.694 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.426 ' HB3' HD23 ' A' ' 58' ' ' LEU . 20.5 m-85 -124.66 147.46 48.53 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.635 -177.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HZ3' HG21 ' A' ' 34' ' ' ILE . 87.8 tttt -143.7 119.6 10.62 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.794 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.0 mt -92.22 126.55 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 120.908 0.385 . . . . 0.0 110.884 175.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -143.37 168.19 20.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.598 -0.273 . . . . 0.0 110.979 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG3' ' A' ' 12' ' ' GLU . 29.0 t -71.25 145.34 49.65 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.977 0.418 . . . . 0.0 111.61 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 25.5 tpt85 -56.84 -31.28 64.6 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.965 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.25 -47.2 74.52 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.356 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 43.4 mt-10 -60.07 -42.19 94.03 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.233 0.54 . . . . 0.0 110.893 177.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.5 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 20.0 t-105 -70.22 -36.49 74.6 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.582 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.26 -52.02 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.611 0.72 . . . . 0.0 110.465 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.72 -36.56 79.15 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.521 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.408 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . . . -61.16 -46.89 88.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.957 0.408 . . . . 0.0 111.259 175.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.3 mttm -56.98 -41.56 78.6 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.632 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.9 -45.8 91.38 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.25 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -67.49 -26.44 66.36 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.037 0.446 . . . . 0.0 111.287 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.425 ' O ' HG23 ' A' ' 90' ' ' VAL . . . 87.35 -2.34 86.5 Favored Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.716 -170.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ptt-85 -160.37 168.6 24.87 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.8 0.334 . . . . 0.0 111.325 -176.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 16' ' ' ALA . 36.6 t80 -136.12 99.65 4.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.252 0.549 . . . . 0.0 110.111 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -94.44 172.89 7.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.091 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -74.97 140.25 26.4 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.688 -175.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.4 m -81.23 167.27 19.78 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 122.789 -0.242 . . . . 0.0 110.422 174.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.93 -32.65 46.76 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.878 0.37 . . . . 0.0 111.252 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.46 -51.31 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.222 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.09 -51.0 63.26 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.47 -32.38 64.92 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.743 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.27 -44.87 51.05 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.987 0.422 . . . . 0.0 111.59 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.97 -34.27 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.19 0.519 . . . . 0.0 111.21 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 138.9 52.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.929 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 65.46 -168.2 0.21 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 122.917 0.487 . . . . 0.0 111.491 -175.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.404 HG21 ' HZ3' ' A' ' 6' ' ' LYS . 57.5 mt -54.26 104.42 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 121.234 0.54 . . . . 0.0 112.117 -173.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -77.58 115.46 17.36 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.367 0.603 . . . . 0.0 111.757 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.509 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 65.1 mt -101.72 -170.27 1.8 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.814 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.8 p -141.31 156.2 45.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -94.63 -177.64 4.28 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.155 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.4 -78.77 0.1 OUTLIER Glycine 0 CA--C 1.53 1.03 0 N-CA-C 114.028 0.371 . . . . 0.0 114.028 -176.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -63.53 -28.48 69.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.202 -0.587 . . . . 0.0 111.651 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.87 -38.75 89.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.586 0.231 . . . . 0.0 111.562 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.25 -48.31 82.28 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.732 0.301 . . . . 0.0 110.948 175.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -59.55 -51.3 70.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.726 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.667 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 11.7 tp10 -62.58 -52.23 64.2 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.216 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 49.8 m -58.62 -38.07 77.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.878 0.37 . . . . 0.0 111.073 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -61.73 -44.61 96.59 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.823 0.344 . . . . 0.0 111.334 176.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.94 -25.6 64.64 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.667 ' HE2' ' HG3' ' A' ' 44' ' ' GLU . 54.5 mttm -88.44 -51.88 5.48 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -105.48 -43.02 5.06 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -169.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.511 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.1 m-85 -85.06 -2.07 57.57 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -174.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.8 ptt85 -62.36 130.96 47.63 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.087 0.47 . . . . 0.0 111.58 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.39 -7.83 80.53 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.267 -0.492 . . . . 0.0 113.457 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.419 ' HB2' HD11 ' A' ' 56' ' ' LEU . 70.4 mt-30 -91.36 116.75 29.09 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.229 -0.571 . . . . 0.0 111.022 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.66 155.76 19.41 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.897 0.38 . . . . 0.0 111.391 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 63.37 73.0 0.46 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.47 0.652 . . . . 0.0 111.435 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 53' ' ' GLN . 97.1 mt -120.76 154.3 35.85 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.804 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.1 t -128.78 138.74 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.939 0.4 . . . . 0.0 111.257 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.426 HD23 ' HB3' ' A' ' 5' ' ' TYR . 5.9 tt -112.95 108.69 17.71 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.973 0.416 . . . . 0.0 109.941 176.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.15 110.98 17.17 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.205 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.434 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.83 117.38 34.22 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.51 130.88 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 120.96 0.409 . . . . 0.0 111.667 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.17 108.52 14.89 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.053 0.454 . . . . 0.0 110.848 176.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.439 ' O ' ' N ' ' A' ' 1' ' ' MET . . . -85.83 52.94 2.61 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -169.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.49 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 44.5 mt-10 -80.92 -58.32 0.53 Allowed Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.914 -0.491 . . . . 0.0 111.975 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.49 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 83.1 Cg_endo -76.68 -38.72 0.86 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 122.07 1.847 . . . . 0.0 113.338 -178.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -98.57 21.66 10.95 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.185 0.517 . . . . 0.0 111.561 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.52 -11.14 40.11 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 115.0 0.76 . . . . 0.0 115.0 -174.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -121.5 4.69 10.16 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 117.753 0.777 . . . . 0.0 111.49 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.558 ' HB3' ' HD3' ' A' ' 86' ' ' ARG . 2.3 m-20 -80.45 -1.94 43.67 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 111.008 175.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.605 HD11 HG21 ' A' ' 4' ' ' ILE . 2.7 pt? -137.07 163.83 29.85 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.026 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -123.79 126.22 46.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.997 0.427 . . . . 0.0 111.92 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -80.29 82.73 6.28 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.174 0.512 . . . . 0.0 110.315 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -77.94 98.24 5.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.328 0.585 . . . . 0.0 112.178 -175.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -92.16 67.72 5.05 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.546 0.689 . . . . 0.0 110.006 172.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 79.8 p -129.37 -73.13 0.57 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.612 -176.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -70.27 102.38 2.11 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.773 0.32 . . . . 0.0 111.191 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.91 -19.4 41.16 Favored Glycine 0 CA--C 1.525 0.698 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.046 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.65 -33.74 4.85 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 121.279 -0.486 . . . . 0.0 113.987 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -77.72 169.46 18.26 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.113 0.483 . . . . 0.0 112.015 -178.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -83.28 110.19 17.89 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -115.26 105.71 52.12 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.509 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 44.7 Cg_endo -71.76 114.26 3.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.564 2.176 . . . . 0.0 112.694 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -108.74 118.6 37.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.879 175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.94 116.07 28.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.069 0.462 . . . . 0.0 110.43 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -87.14 9.32 20.31 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.023 0.44 . . . . 0.0 111.771 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.558 ' HD3' ' HB3' ' A' ' 69' ' ' ASP . 35.1 mtp85 -129.52 149.41 72.79 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.065 -176.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.62 132.14 28.04 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.635 2.224 . . . . 0.0 112.701 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.418 HD22 HG23 ' A' ' 93' ' ' VAL . 10.1 tt -89.6 106.32 18.38 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.9 mt -74.46 138.55 43.31 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.256 -0.277 . . . . 0.0 110.369 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 20' ' ' GLY . 26.2 m -61.19 -31.46 50.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.862 -0.524 . . . . 0.0 111.763 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 84.9 p -67.47 -12.28 59.92 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.67 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -90.65 -21.57 21.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.578 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.418 HG23 HD22 ' A' ' 88' ' ' LEU . 48.7 t -62.21 118.15 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.694 0.283 . . . . 0.0 111.687 -176.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.434 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 87.8 m -58.45 -56.38 22.9 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.017 0.437 . . . . 0.0 111.125 177.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -145.0 144.63 31.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.219 0.533 . . . . 0.0 111.483 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -116.5 103.53 10.51 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.39 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -91.03 107.39 19.17 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.761 0.315 . . . . 0.0 111.827 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.65 111.35 4.74 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.08 119.33 9.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.471 0.653 . . . . 0.0 112.43 -173.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -71.73 -42.17 67.62 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.614 -176.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.4 mt 68.27 132.79 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.246 0.618 . . . . 0.0 111.836 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -140.09 162.29 35.59 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.272 0.558 . . . . 0.0 111.896 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.19 -79.82 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -105.21 11.97 32.44 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -171.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 71.89 30.08 66.3 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.026 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.78 142.3 26.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.123 0.569 . . . . 0.0 109.999 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.487 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 13.0 Cg_exo -71.99 103.72 1.53 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 122.13 1.887 . . . . 0.0 112.68 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -80.88 80.83 7.28 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.16 0.505 . . . . 0.0 111.643 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.9 mp -66.11 -26.67 67.56 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 122.048 -0.408 . . . . 0.0 110.864 174.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.28 -23.05 46.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.338 -0.458 . . . . 0.0 113.333 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -98.76 -11.73 21.61 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 122.463 -0.433 . . . . 0.0 111.584 175.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -88.8 -37.95 15.02 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.808 0.337 . . . . 0.0 111.502 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 14.0 mt -86.89 -172.15 3.85 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.301 -175.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.05 71.93 1.63 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.852 0.358 . . . . 0.0 111.854 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.1 mt 57.1 -88.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.179 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 121.312 0.577 . . . . 0.0 112.216 177.5 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p -96.13 145.83 25.17 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.97 123.54 46.06 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.864 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.424 HD13 HD12 ' A' ' 36' ' ' LEU . 13.1 pt -108.71 153.75 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -177.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.431 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 94.9 m-85 -131.85 163.11 28.99 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.583 0.706 . . . . 0.0 112.536 -176.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.61 ' HZ3' ' HB2' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -157.95 115.56 3.0 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 177.198 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.5 mt -102.38 127.43 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.613 0.244 . . . . 0.0 111.339 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' N ' HD21 ' A' ' 8' ' ' LEU . 2.2 pt? -151.92 166.0 32.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.916 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 m -69.46 146.71 51.74 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 122.3 -0.25 . . . . 0.0 111.67 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -57.25 -52.2 66.3 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.46 -39.76 64.73 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.162 0.506 . . . . 0.0 111.409 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -67.11 -36.33 81.69 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.847 177.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -64.28 -48.49 75.48 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.221 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.28 -30.22 69.32 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.53 0.205 . . . . 0.0 111.375 176.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.05 -60.19 3.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.989 0.423 . . . . 0.0 110.882 174.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.21 -35.22 69.37 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 111.266 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.558 ' HA ' HG22 ' A' ' 90' ' ' VAL . 26.5 ttpp -69.92 -31.87 69.87 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.395 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.87 -21.7 61.62 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.303 0.573 . . . . 0.0 111.037 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -87.74 -23.13 24.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.971 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.95 -2.74 63.64 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 121.275 -0.488 . . . . 0.0 112.117 -172.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.56 ' HG3' HD23 ' A' ' 89' ' ' LEU . 54.0 ttp180 -143.13 141.53 31.23 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.006 0.431 . . . . 0.0 111.663 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -110.16 109.67 20.27 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.627 176.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -122.56 90.33 3.28 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.615 0.721 . . . . 0.0 112.226 179.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.98 101.62 0.02 OUTLIER Glycine 0 CA--C 1.533 1.194 0 N-CA-C 115.671 1.028 . . . . 0.0 115.671 171.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.2 m -76.75 177.9 7.22 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 167.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.06 -46.45 33.5 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.112 0.482 . . . . 0.0 112.294 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.0 t -70.06 -44.59 78.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.739 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.35 -27.5 69.06 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.87 0.367 . . . . 0.0 111.481 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.48 -36.3 73.77 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.312 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.16 -49.0 77.6 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.741 172.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.04 -28.17 69.4 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.623 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.82 -45.96 3.09 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -175.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -116.68 145.26 43.56 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -52.8 114.67 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -176.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -90.45 107.96 19.48 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.813 0.816 . . . . 0.0 110.532 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.586 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 35.0 mt -89.45 54.88 3.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.522 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -45.87 107.12 0.09 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.897 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -103.31 147.05 27.56 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.6 -113.43 3.08 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 115.541 -0.754 . . . . 0.0 114.667 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -54.89 -47.67 74.02 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -59.81 -39.97 86.84 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.757 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.36 -56.55 19.09 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.939 0.399 . . . . 0.0 111.445 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -61.74 -49.7 75.36 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.8 -22.38 66.98 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -176.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.0 m -81.0 -40.5 24.22 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.21 0.529 . . . . 0.0 110.311 171.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.57 74.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.278 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.403 ' O ' ' HD3' ' A' ' 51' ' ' ARG . . . -62.58 -24.57 67.62 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -100.31 -56.54 2.33 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.129 0.49 . . . . 0.0 111.971 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -78.6 -37.72 41.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -109.25 8.85 25.9 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -172.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 47' ' ' ALA . 13.5 ptt180 -61.25 136.62 58.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.979 0.419 . . . . 0.0 111.654 178.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.66 -26.02 16.14 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.404 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -85.82 116.23 23.95 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 122.534 -0.392 . . . . 0.0 111.424 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.471 ' HB1' ' HA ' ' A' ' 100' ' ' ASP . . . -103.89 -0.46 29.05 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -92.03 15.78 12.59 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.65 159.08 18.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -177.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.7 143.34 38.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.988 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.0 tt -98.68 133.57 42.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.796 0.331 . . . . 0.0 110.967 175.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.4 mt -104.94 130.01 53.21 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.322 0.249 . . . . 0.0 110.975 177.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -118.84 122.19 41.78 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.721 0.296 . . . . 0.0 110.915 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.2 t -133.84 137.88 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.735 0.302 . . . . 0.0 111.562 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -77.19 127.65 32.99 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 170.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -52.36 64.12 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -175.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.462 ' HG3' ' HD2' ' A' ' 65' ' ' PRO . 35.0 tt0 69.43 141.52 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.921 0 C-N-CA 122.885 0.474 . . . . 0.0 110.874 -173.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.462 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 24.4 Cg_endo -61.59 77.45 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.575 2.184 . . . . 0.0 112.65 177.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.4 mt -72.64 -59.38 2.75 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.661 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.78 -118.71 0.79 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.365 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -130.38 18.26 5.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 122.381 -0.482 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -79.37 -36.6 39.04 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.83 0.348 . . . . 0.0 111.554 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -81.55 101.82 10.21 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.254 0.549 . . . . 0.0 110.804 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HD3' ' CE1' ' A' ' 85' ' ' TYR . 48.9 mtpt -95.67 109.87 22.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.136 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.517 ' CZ3' ' HG3' ' A' ' 82' ' ' PRO . 78.1 m95 -74.25 73.38 1.8 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.717 0.77 . . . . 0.0 109.256 167.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -90.15 117.5 28.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.246 -169.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -86.71 132.8 33.77 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 176.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.2 t -145.52 178.89 7.79 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 62.97 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.903 0.481 . . . . 0.0 111.7 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.32 23.65 0.44 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.38 -158.64 26.98 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.982 -0.447 . . . . 0.0 111.982 -176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 62.87 111.42 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.253 0.549 . . . . 0.0 112.371 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 -82.16 93.4 7.05 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.938 0.399 . . . . 0.0 111.63 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -78.86 113.98 39.99 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.515 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.586 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 12.3 Cg_exo -69.61 88.31 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.464 2.109 . . . . 0.0 112.494 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -88.52 106.49 18.32 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.5 tp -92.05 122.65 34.75 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.05 0.453 . . . . 0.0 111.229 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.502 ' CE1' ' HD3' ' A' ' 71' ' ' LYS . 2.0 m-85 -86.43 21.18 2.18 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.1 mtm180 -132.6 143.15 47.55 Favored Pre-proline 0 N--CA 1.473 0.709 0 O-C-N 122.048 -0.408 . . . . 0.0 111.278 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.87 111.12 1.85 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.299 1.999 . . . . 0.0 111.447 172.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.45 114.12 10.23 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.802 -170.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.56 HD23 ' HG3' ' A' ' 21' ' ' ARG . 71.0 mt -73.26 142.28 47.24 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.745 0.307 . . . . 0.0 111.155 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.558 HG22 ' HA ' ' A' ' 17' ' ' LYS . 86.1 t -59.08 -31.39 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.304 0.573 . . . . 0.0 111.06 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.6 p -73.79 -10.83 60.08 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.17 176.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.496 ' HG3' ' HB2' ' A' ' 89' ' ' LEU . 55.3 mt-10 -89.22 -18.31 27.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.852 0.358 . . . . 0.0 110.556 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.1 t -72.52 127.45 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.409 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 89.0 m -73.33 -65.22 0.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.1 ptt-85 -148.18 154.56 40.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.812 0.339 . . . . 0.0 111.767 -174.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.62 174.19 5.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.043 0.449 . . . . 0.0 110.768 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.426 ' HB2' ' CE1' ' A' ' 112' ' ' HIS . . . -152.72 98.17 2.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.808 0.337 . . . . 0.0 111.601 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.08 136.56 39.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.511 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.494 HD21 ' N ' ' A' ' 99' ' ' LEU . 1.5 pt? -141.06 97.52 3.19 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.635 0.731 . . . . 0.0 112.172 -177.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.471 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t70 -84.64 127.93 34.34 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.498 173.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.3 pp -155.28 -171.54 3.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.05 0.452 . . . . 0.0 111.932 -171.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -142.48 -168.07 2.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.755 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.18 -0.73 15.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -175.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -133.56 -31.79 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -54.25 -53.41 37.9 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 110.531 -1.027 . . . . 0.0 110.531 164.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.507 HG13 ' HD2' ' A' ' 107' ' ' PRO . 2.1 t 65.68 146.04 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 170.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.507 ' HD2' HG13 ' A' ' 106' ' ' VAL . 24.1 Cg_exo -33.31 99.37 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.25 0 C-N-CA 123.756 2.97 . . . . 0.0 114.613 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -76.26 78.66 3.04 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.609 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.5 mp -100.19 -16.89 17.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.3 -27.96 48.65 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.246 -0.502 . . . . 0.0 113.921 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.95 -9.79 33.01 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 82.3 m-70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 23.2 mt -81.66 158.41 24.3 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.017 0.437 . . . . 0.0 111.38 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -96.63 15.28 22.16 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.488 HD12 ' HB3' ' A' ' 113' ' ' LEU . 7.2 mp -80.16 97.93 7.1 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.066 0.46 . . . . 0.0 112.022 -176.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 . . . . . 0 N--CA 1.468 0.435 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.576 173.776 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 120.435 0.16 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.5 t 174.86 -169.91 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.558 0.343 . . . . 0.0 111.136 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 89.2 mt -115.64 122.54 45.91 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.878 0.37 . . . . 0.0 110.817 177.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.496 HD13 HD12 ' A' ' 36' ' ' LEU . 23.6 pt -102.51 149.38 7.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.033 0.444 . . . . 0.0 111.458 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.435 ' HB3' HD12 ' A' ' 58' ' ' LEU . 80.3 m-85 -142.65 121.67 12.85 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.772 -174.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' NZ ' HG21 ' A' ' 34' ' ' ILE . 79.6 tttt -110.48 125.29 53.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.921 0.391 . . . . 0.0 110.896 176.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.431 HD11 HD22 ' A' ' 109' ' ' LEU . 65.9 mt -98.29 132.49 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.342 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -145.78 171.06 15.33 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.687 178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.4 p -77.85 148.92 34.43 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.127 0.489 . . . . 0.0 111.324 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -56.72 -36.1 69.31 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.5 -49.03 75.9 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.3 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -70.0 -40.85 75.03 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.503 ' HZ2' ' HG2' ' A' ' 96' ' ' GLU . 41.3 t-105 -63.4 -40.01 96.06 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.492 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 4.7 t0 -62.93 -43.84 97.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.246 0.546 . . . . 0.0 110.039 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.08 -46.08 85.86 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.513 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.62 89.49 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.208 0.527 . . . . 0.0 111.07 175.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.492 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 25.5 ttpp -60.75 -44.14 97.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.984 175.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -38.4 89.89 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.196 0.522 . . . . 0.0 111.352 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.39 -29.13 61.41 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.442 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.1 5.05 89.11 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.736 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 23' ' ' GLU . 57.2 mtp180 -146.28 134.9 22.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.791 0.436 . . . . 0.0 111.278 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -102.11 98.44 8.61 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.449 0.643 . . . . 0.0 110.008 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 21' ' ' ARG . 34.8 mm-40 -80.49 -176.05 5.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.23 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.12 116.81 8.86 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.176 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.4 p -74.21 -174.17 1.87 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.498 -0.413 . . . . 0.0 110.681 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.74 -37.21 65.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.01 0.433 . . . . 0.0 111.12 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.3 t -77.94 -47.22 25.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.11 0.481 . . . . 0.0 111.705 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.65 -43.1 99.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.174 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.63 -28.63 62.87 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.88 73.03 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.046 0.45 . . . . 0.0 110.909 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.51 -31.11 53.28 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.375 173.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.16 -12.45 48.59 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.365 -0.379 . . . . 0.0 112.531 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -141.55 151.51 43.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.997 0.519 . . . . 0.0 111.01 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.412 HG21 ' NZ ' ' A' ' 6' ' ' LYS . 55.1 mt -69.85 135.27 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -171.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -87.2 145.95 26.2 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.899 173.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD11 HD13 ' A' ' 84' ' ' LEU . 78.5 mt -134.64 -69.76 0.51 Allowed 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.535 ' OG ' ' HB2' ' A' ' 41' ' ' GLN . 39.9 t 76.89 165.25 0.25 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.484 0.714 . . . . 0.0 112.343 -175.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' ILE . . . -111.05 176.63 4.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.532 176.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.27 -44.19 7.68 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.441 0.536 . . . . 0.0 114.441 -177.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.06 -66.27 0.41 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.008 0.432 . . . . 0.0 111.929 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.535 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 20.8 mt-30 -76.11 -15.61 60.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -176.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.96 64.88 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.777 0.322 . . . . 0.0 110.686 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.551 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 13.3 tt0 -66.74 -35.73 80.8 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.217 175.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.628 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 63.7 mm-40 -55.21 -60.94 2.69 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.998 0.428 . . . . 0.0 110.724 173.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -54.71 -40.13 68.91 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.449 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.467 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -61.71 -41.04 97.08 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.466 176.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.85 -37.56 64.76 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.628 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 48.8 mttm -78.98 -61.52 1.99 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.02 0.438 . . . . 0.0 111.9 -178.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.55 -40.67 16.04 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -107.57 35.39 3.1 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 122.303 -0.248 . . . . 0.0 111.617 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -24.01 -51.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.711 1.204 . . . . 0.0 113.955 -174.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.53 50.14 0.46 Allowed Glycine 0 CA--C 1.525 0.695 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.731 177.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.526 ' HB2' HD22 ' A' ' 56' ' ' LEU . 77.6 mm-40 -77.46 124.74 28.3 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.544 -0.386 . . . . 0.0 111.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.46 68.25 4.85 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.128 0.489 . . . . 0.0 112.095 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -175.39 22.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.303 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.526 HD22 ' HB2' ' A' ' 53' ' ' GLN . 42.1 mt -84.21 141.02 31.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.396 0.617 . . . . 0.0 112.288 -173.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.1 t -123.47 128.59 74.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.381 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.435 HD12 ' HB3' ' A' ' 5' ' ' TYR . 52.7 tp -95.82 114.03 25.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.299 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.2 mt -91.56 105.8 18.01 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.805 0.336 . . . . 0.0 110.96 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.69 112.73 24.66 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.479 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 93' ' ' VAL . 20.7 t -130.59 137.36 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.949 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.83 133.74 39.26 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 173.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.37 -74.09 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 59.18 161.52 0.09 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -59.73 -62.13 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.119 1.879 . . . . 0.0 112.182 169.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.3 pp 34.61 33.71 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.98 121.42 4.91 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.849 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.83 -1.12 0.56 Allowed 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -61.02 -25.43 66.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.761 0.315 . . . . 0.0 111.329 174.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.79 106.14 16.81 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.911 0.386 . . . . 0.0 110.295 174.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HE2' ' HG2' ' A' ' 73' ' ' GLU . 78.3 tttt -125.86 128.39 47.55 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -174.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 75.0 m95 -79.38 105.6 10.81 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.213 -0.304 . . . . 0.0 111.238 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.431 ' HG2' ' HE2' ' A' ' 71' ' ' LYS . 44.3 mt-10 -118.46 131.08 56.27 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 111.784 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -94.26 115.68 27.96 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.2 t -75.89 173.61 10.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.24 0.543 . . . . 0.0 112.168 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -64.94 98.03 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.476 0.655 . . . . 0.0 111.599 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 147.49 -33.13 1.33 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.134 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.23 -28.23 3.67 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.45 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -57.73 123.98 17.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 68.4 mtm180 -97.6 96.85 8.57 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.279 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.403 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 68.3 m-85 -104.95 112.81 65.26 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.512 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 27.9 Cg_endo -64.16 108.3 0.94 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.079 1.853 . . . . 0.0 111.748 173.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -90.47 126.15 35.81 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.348 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.588 HD13 HD11 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -96.45 112.69 24.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.419 178.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -78.69 3.29 16.87 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 120.794 0.331 . . . . 0.0 111.616 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.412 ' HB3' HD23 ' A' ' 84' ' ' LEU . 7.1 tpp180 -119.29 140.1 28.54 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 122.929 0.492 . . . . 0.0 110.635 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -53.19 139.08 63.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.45 2.1 . . . . 0.0 112.484 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.0 tt -88.81 107.11 18.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.188 0.518 . . . . 0.0 111.049 -173.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.521 ' HB2' ' HG2' ' A' ' 92' ' ' GLU . 50.8 mt -79.35 130.79 35.78 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.54 -22.88 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 O-C-N 121.845 -0.534 . . . . 0.0 111.808 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 58.6 m -66.97 -15.97 64.05 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.532 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.521 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 51.4 mm-40 -81.51 -18.32 45.51 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.522 ' HA ' HG22 ' A' ' 61' ' ' VAL . 59.6 t -70.87 117.96 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 120.961 0.41 . . . . 0.0 111.879 -176.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.5 m -60.8 -46.95 88.5 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.966 0.413 . . . . 0.0 111.33 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -159.19 148.52 18.57 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.748 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.503 ' HG2' ' HZ2' ' A' ' 13' ' ' TRP . 0.4 OUTLIER -134.02 154.84 50.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.657 0.265 . . . . 0.0 111.14 177.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -166.82 150.05 6.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.878 0.37 . . . . 0.0 111.737 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -66.27 123.73 20.75 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.518 HD22 HD12 ' A' ' 109' ' ' LEU . 54.2 tp -78.31 128.55 33.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.585 -174.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -92.26 156.34 17.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.971 0.415 . . . . 0.0 111.306 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 73.7 mt -100.31 174.69 6.01 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.241 0.543 . . . . 0.0 112.016 -175.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.45 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 31.4 t70 -100.95 173.27 6.56 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.346 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.07 -33.16 37.97 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.948 0.404 . . . . 0.0 111.601 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.83 -28.98 24.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.254 0.549 . . . . 0.0 110.633 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.04 -23.78 6.46 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.605 -174.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.3 t -59.24 119.21 36.93 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.467 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 33.9 Cg_exo -59.19 111.32 0.88 Allowed 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 122.538 2.159 . . . . 0.0 112.817 177.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.45 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 85.2 mm-40 -88.79 84.86 6.68 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.299 0.571 . . . . 0.0 112.355 -175.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.551 ' HB2' ' HB2' ' A' ' 43' ' ' GLN . 7.5 mp -81.94 -35.64 28.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.495 177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.76 -34.73 29.62 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.949 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.47 -33.38 21.87 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.876 0.369 . . . . 0.0 111.415 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.65 -27.13 65.72 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 48.9 mt -94.03 179.71 5.24 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.196 0.522 . . . . 0.0 112.108 -175.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -78.57 71.15 5.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.988 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.3 tp -80.5 78.8 7.19 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.26 0.552 . . . . 0.0 110.631 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 121.272 0.558 . . . . 0.0 111.561 179.172 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 120.812 0.339 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.498 ' HB ' ' HB1' ' A' ' 63' ' ' ALA . 61.6 m -75.72 87.5 2.77 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.099 0.476 . . . . 0.0 111.14 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -76.75 111.83 12.69 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.9 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.429 HD13 HD11 ' A' ' 36' ' ' LEU . 6.9 pt -96.32 135.14 31.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.08 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 71.7 m-85 -116.09 155.96 27.24 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -172.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.467 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 63.0 tttp -154.82 129.65 9.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.627 174.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.55 120.62 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 120.605 0.241 . . . . 0.0 110.931 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -135.49 158.48 44.26 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.838 0.351 . . . . 0.0 111.237 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 p -69.92 151.36 45.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.211 0.529 . . . . 0.0 112.088 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -58.81 -60.69 3.44 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.54 -33.79 64.12 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -69.41 -38.82 78.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.897 0.379 . . . . 0.0 111.088 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 44.1 t-105 -64.67 -46.48 82.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.812 0.339 . . . . 0.0 110.77 174.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.6 -37.06 84.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 176.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -61.76 -53.63 53.43 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.968 0.413 . . . . 0.0 110.828 175.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.32 -37.64 78.28 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.162 0.506 . . . . 0.0 111.311 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.541 ' HA ' HG22 ' A' ' 90' ' ' VAL . 25.7 ttpp -67.42 -33.74 75.8 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.05 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.04 -36.43 79.91 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.267 0.556 . . . . 0.0 110.676 173.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 76.2 mm-40 -74.36 -29.45 61.57 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.0 175.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.79 2.97 74.62 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 115.993 -0.548 . . . . 0.0 112.587 -175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -154.19 129.0 9.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 111.62 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.467 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 65.1 t80 -95.92 97.9 9.99 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.172 0.51 . . . . 0.0 110.204 173.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.25 -36.67 71.85 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.132 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.44 157.7 7.66 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.533 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -84.47 170.05 13.89 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.396 0.279 . . . . 0.0 110.916 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.86 -43.8 69.84 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.074 0.464 . . . . 0.0 111.405 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.9 t -61.82 -32.37 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.503 176.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 71.1 m-20 -72.89 -49.89 27.05 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.943 0.401 . . . . 0.0 111.226 179.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.43 -34.69 78.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.809 0.337 . . . . 0.0 111.618 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.52 78.6 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.083 0.468 . . . . 0.0 111.485 176.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.74 -38.93 37.65 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.008 0.432 . . . . 0.0 111.53 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.86 -20.55 28.98 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.887 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -129.59 160.23 33.91 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.685 0.394 . . . . 0.0 110.48 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.54 ' O ' HG22 ' A' ' 34' ' ' ILE . 32.7 mt -75.86 12.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.4 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 32.0 m-70 49.59 88.74 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.654 -0.654 . . . . 0.0 112.356 -178.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 73.0 mt -117.45 155.88 28.93 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 122.156 -0.34 . . . . 0.0 110.628 176.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -141.9 149.03 39.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.67 -179.9 4.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.143 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -48.3 -63.3 3.76 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 121.463 -0.399 . . . . 0.0 114.054 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -55.6 -50.03 71.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.248 0.546 . . . . 0.0 111.674 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -60.89 -33.42 73.08 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.862 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.76 -44.74 66.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.012 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.48 -35.79 81.93 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.181 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.14 -56.87 11.78 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.895 0.378 . . . . 0.0 110.296 174.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 97.0 m -55.02 -31.62 61.2 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.274 176.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.83 -58.73 4.94 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.899 0.38 . . . . 0.0 111.176 175.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.81 69.01 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -87.54 -45.62 10.3 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -112.39 -52.11 2.8 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.555 ' HB3' HE22 ' A' ' 53' ' ' GLN . 97.1 m-85 -102.45 60.18 0.82 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.677 0.751 . . . . 0.0 111.521 -170.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -106.4 3.37 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.432 ' HA2' HD12 ' A' ' 101' ' ' LEU . . . -113.9 60.06 0.38 Allowed Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.916 171.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.555 HE22 ' HB3' ' A' ' 50' ' ' PHE . 6.8 mm-40 -73.69 110.07 7.7 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.9 -66.82 1.02 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -137.1 61.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.549 0.69 . . . . 0.0 110.902 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.19 -179.96 5.54 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.171 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.9 t -134.86 147.37 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.98 0.419 . . . . 0.0 111.675 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 70.2 tp -101.32 108.88 20.63 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.657 174.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.8 mt -84.75 147.84 26.66 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.887 0.375 . . . . 0.0 111.701 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.516 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -141.39 131.48 24.73 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 176.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.7 t -136.59 141.7 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -74.44 120.49 20.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.723 0.409 . . . . 0.0 111.15 173.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.498 ' HB1' ' HB ' ' A' ' 2' ' ' THR . . . -77.61 -35.09 53.15 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -56.91 -55.28 45.33 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -173.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.43 0.11 9.46 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.141 1.894 . . . . 0.0 114.301 -170.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.28 -49.82 68.07 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 122.14 -0.35 . . . . 0.0 111.72 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.3 42.01 0.48 Allowed Glycine 0 CA--C 1.525 0.697 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.701 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 55.65 20.41 3.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.522 ' HB3' ' HG3' ' A' ' 86' ' ' ARG . 8.8 m-20 -70.7 -16.07 62.76 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.983 0.42 . . . . 0.0 111.85 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 82' ' ' PRO . 39.4 tp -90.21 112.0 23.36 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.887 0.375 . . . . 0.0 110.929 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.544 ' HD2' ' HB2' ' A' ' 73' ' ' GLU . 3.7 tmtp? -95.61 104.27 16.18 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.862 0.363 . . . . 0.0 110.904 -178.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -69.55 94.33 0.75 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 110.022 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.544 ' HB2' ' HD2' ' A' ' 71' ' ' LYS . 11.7 tp10 -122.27 138.39 54.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.773 -169.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.442 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -83.32 176.47 9.1 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.37 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.1 t -168.42 -171.58 1.5 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.161 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.7 mtp85 -54.07 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 111.467 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 144.36 -16.98 2.08 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.489 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.22 -4.17 77.9 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.902 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -95.6 129.44 42.8 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.387 -0.478 . . . . 0.0 111.936 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.442 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 87.5 mtt180 -80.29 109.46 14.79 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.978 0.418 . . . . 0.0 111.3 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -98.58 139.06 20.87 Favored Pre-proline 0 C--O 1.239 0.528 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 176.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.527 ' HB2' HD11 ' A' ' 70' ' ' LEU . 28.8 Cg_endo -63.24 97.22 0.19 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.279 1.986 . . . . 0.0 112.126 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -91.14 104.94 17.45 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.053 0.454 . . . . 0.0 111.995 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.3 tp -97.46 122.5 40.58 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.726 175.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -106.26 16.88 24.26 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.209 0.528 . . . . 0.0 111.424 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HG3' ' HB3' ' A' ' 69' ' ' ASP . 18.7 mmm180 -112.03 130.78 22.91 Favored Pre-proline 0 N--CA 1.47 0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.83 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.29 116.32 2.88 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.658 2.239 . . . . 0.0 112.709 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 50.0 tp -74.13 95.26 2.54 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 121.072 0.463 . . . . 0.0 111.622 -175.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.3 mt -59.67 122.9 15.27 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.541 HG22 ' HA ' ' A' ' 17' ' ' LYS . 83.0 t -61.58 -34.1 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.875 0.369 . . . . 0.0 111.966 -176.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -72.74 0.32 11.15 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -118.56 -1.15 11.23 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.866 0.365 . . . . 0.0 111.302 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 79.8 t -74.3 139.26 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 122.183 -0.323 . . . . 0.0 111.539 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 37.0 m -69.36 -59.44 2.99 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 95' ' ' ARG . 1.9 mmp_? -147.07 151.1 36.33 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 8.0 pt-20 -129.92 95.91 4.07 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.891 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.56 132.07 44.27 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.99 149.92 41.02 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.68 171.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.507 HD23 ' N ' ' A' ' 99' ' ' LEU . 1.9 pt? -150.85 146.22 26.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.094 0.473 . . . . 0.0 112.091 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -127.71 -161.49 1.09 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.81 177.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.432 HD12 ' HA2' ' A' ' 52' ' ' GLY . 98.1 mt -117.22 135.74 53.57 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -143.72 -175.55 4.62 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.665 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.83 -78.19 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 177.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -139.13 17.92 2.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.651 0.739 . . . . 0.0 110.223 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 100.2 32.47 5.53 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.093 -173.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.6 t -116.95 132.2 23.56 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 122.52 0.328 . . . . 0.0 110.665 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -79.17 77.3 4.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.865 1.71 . . . . 0.0 111.163 171.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.07 83.72 0.51 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 122.733 1.254 . . . . 0.0 111.577 -174.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 6.39 0.27 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.256 -1.338 . . . . 0.0 113.216 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.32 -25.97 4.61 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.431 -0.414 . . . . 0.0 113.644 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.5 -36.65 84.87 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.596 0.713 . . . . 0.0 110.658 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -76.7 -23.91 53.12 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.335 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.66 160.76 14.95 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.917 0.389 . . . . 0.0 111.76 -174.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -91.83 -83.17 0.29 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.426 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 58.36 172.61 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 . . . . . 0 CA--C 1.547 0.846 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.042 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.4 mtm . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.8 p 54.97 128.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.2 mt -125.66 150.99 47.14 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.5 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.682 HG13 HD11 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -125.02 149.8 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 120.726 0.298 . . . . 0.0 110.757 174.179 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -130.9 141.46 50.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 35' ' ' HIS . 24.9 ttmm -134.91 127.45 30.66 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.999 173.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.52 ' N ' HD13 ' A' ' 7' ' ' ILE . 3.4 mp -101.3 130.74 50.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.436 ' N ' HD21 ' A' ' 8' ' ' LEU . 2.2 pt? -154.94 166.27 34.08 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.789 177.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 57.4 p -78.46 143.15 36.95 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 122.185 -0.322 . . . . 0.0 110.381 178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.533 ' HA ' ' HB3' ' A' ' 13' ' ' TRP . 79.7 ttt180 -60.97 -25.2 66.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.0 -32.15 67.64 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.03 0.443 . . . . 0.0 111.288 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -89.51 -34.82 16.26 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.244 0.545 . . . . 0.0 110.982 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.533 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 15.8 t-105 -62.02 -53.92 48.8 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.885 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.59 -30.4 67.17 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.084 0.469 . . . . 0.0 110.191 172.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.7 -48.84 79.75 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.633 177.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -62.16 -30.9 71.37 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.58 -36.89 63.05 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.12 0.486 . . . . 0.0 110.976 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -71.66 -25.74 62.25 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.769 177.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 -15.69 53.71 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.206 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.535 ' NH2' ' HG2' ' A' ' 87' ' ' PRO . 49.4 ttt180 -140.03 147.2 40.02 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.115 0.483 . . . . 0.0 111.461 -177.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -116.46 88.05 2.81 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.793 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.73 -15.43 62.82 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.027 0.441 . . . . 0.0 111.313 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.69 175.49 13.95 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.993 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.6 p -75.3 -176.94 3.29 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 122.634 -0.333 . . . . 0.0 110.457 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.58 62.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.222 0.534 . . . . 0.0 110.637 172.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.3 t -78.04 -52.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.583 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -58.02 -42.32 85.05 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.925 0.393 . . . . 0.0 111.245 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.65 -35.16 74.94 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.338 179.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.0 -51.72 68.49 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 110.917 175.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.37 -34.9 76.88 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.138 0.494 . . . . 0.0 111.485 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.52 -40.42 2.59 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.394 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -98.17 117.91 33.6 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.488 0.315 . . . . 0.0 110.827 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.519 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 64.5 mt -64.78 122.42 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.413 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 47.4 m-70 -83.58 124.85 31.19 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.365 175.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.682 HD11 HG13 ' A' ' 4' ' ' ILE . 98.9 mt -113.35 -64.42 1.31 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.448 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 26.5 m 73.46 154.95 0.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.207 0.527 . . . . 0.0 111.85 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.08 -176.63 5.2 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.07 -64.73 3.91 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 114.285 0.474 . . . . 0.0 114.285 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 9.7 mp0 -56.54 -47.59 79.1 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 117.082 0.441 . . . . 0.0 111.117 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.448 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 29.9 mt-30 -57.09 -35.77 69.8 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.968 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.31 -48.87 60.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.871 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.662 ' HB2' HD22 ' A' ' 109' ' ' LEU . 37.1 tt0 -65.86 -34.95 79.33 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.365 -0.209 . . . . 0.0 111.488 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.1 mt-10 -64.42 -51.08 64.99 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 175.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 m -60.2 -40.31 89.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.248 0.547 . . . . 0.0 110.463 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.608 ' HB3' ' HG2' ' A' ' 51' ' ' ARG . . . -61.43 -47.41 85.86 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.709 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.434 ' HB1' HG13 ' A' ' 106' ' ' VAL . . . -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.315 0.578 . . . . 0.0 111.973 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.36 -41.81 14.2 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.684 -176.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.8 -6.04 13.86 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -166.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -144.71 -69.65 0.29 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.608 ' HG2' ' HB3' ' A' ' 46' ' ' ALA . 25.4 mmt180 -57.99 93.0 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.719 0.771 . . . . 0.0 112.918 -173.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.41 26.93 0.05 OUTLIER Glycine 0 CA--C 1.525 0.685 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.01 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.705 HE21 HD22 ' A' ' 56' ' ' LEU . 11.5 pt20 -165.8 176.47 7.92 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.747 0.308 . . . . 0.0 111.627 -174.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.81 166.98 14.2 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.4 ' O ' ' HA ' ' A' ' 9' ' ' SER . 87.6 m-20 65.08 19.48 11.82 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 175.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.705 HD22 HE21 ' A' ' 53' ' ' GLN . 65.1 mt -84.81 93.47 8.49 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.97 139.62 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.179 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.416 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 63.3 tp -107.4 99.92 9.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 74.2 mt -75.96 105.36 6.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.983 0.42 . . . . 0.0 111.027 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.21 102.6 12.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.767 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -105.2 139.82 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.802 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -79.29 115.33 18.88 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.554 0.216 . . . . 0.0 110.741 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.43 21.36 1.19 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.326 0.584 . . . . 0.0 111.192 177.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.587 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 32.6 tt0 -71.17 -41.1 10.21 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -176.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.587 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 11.7 Cg_endo -55.71 -67.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 121.742 1.628 . . . . 0.0 111.865 173.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.84 58.56 5.33 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 121.122 0.487 . . . . 0.0 112.278 171.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -98.43 -109.41 2.87 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.364 -0.446 . . . . 0.0 112.448 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 14.58 27.21 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.618 0.723 . . . . 0.0 110.558 173.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.568 ' HA ' HH11 ' A' ' 86' ' ' ARG . 0.8 OUTLIER -89.88 -69.54 0.71 Allowed 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.165 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 HD12 ' A' ' 36' ' ' LEU . 58.7 tp -100.29 134.54 43.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -176.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -124.39 128.34 48.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.756 0.312 . . . . 0.0 111.639 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -74.0 106.59 5.76 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.09 136.6 51.41 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.801 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -132.72 102.98 5.89 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -176.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 78.9 p -54.59 -48.28 72.33 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.154 0.502 . . . . 0.0 111.577 175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -80.38 5.57 14.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.402 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.72 -67.13 3.6 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.158 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.51 144.71 29.56 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.899 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 66.14 95.93 0.06 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.168 0.509 . . . . 0.0 111.19 -175.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.801 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 68.7 mtp180 -87.31 117.53 26.14 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.815 -172.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -90.07 113.08 55.89 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.52 115.05 2.41 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.959 1.773 . . . . 0.0 112.052 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -115.63 136.88 52.62 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.933 0.397 . . . . 0.0 111.453 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 38.1 tp -98.44 107.13 19.52 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.099 0.476 . . . . 0.0 110.511 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -83.26 30.77 0.46 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -175.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.568 HH11 ' HA ' ' A' ' 69' ' ' ASP . 4.2 ptm180 -159.14 143.93 11.51 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 122.328 -0.232 . . . . 0.0 111.274 -177.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.535 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 13.9 Cg_endo -57.38 119.14 6.21 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.603 2.202 . . . . 0.0 112.945 177.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 tp -72.49 148.6 44.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.779 -174.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.474 HD22 ' HG3' ' A' ' 21' ' ' ARG . 42.9 mt -96.67 146.81 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 122.102 -0.374 . . . . 0.0 110.529 177.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.04 -39.74 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 O-C-N 122.05 -0.406 . . . . 0.0 111.427 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 t -72.17 -7.59 50.04 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.087 0.47 . . . . 0.0 111.1 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -97.9 -7.3 30.51 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.408 0.623 . . . . 0.0 110.518 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.4 t -85.82 110.74 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.847 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.636 HG21 ' HD3' ' A' ' 95' ' ' ARG . 4.0 m -64.59 -67.91 0.4 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.636 ' HD3' HG21 ' A' ' 94' ' ' THR . 1.3 mpp_? -115.18 130.9 57.04 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 14.3 pt-20 -103.07 87.8 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.579 0.704 . . . . 0.0 109.641 169.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -85.23 140.2 31.06 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -171.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -83.58 157.37 22.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.134 0.492 . . . . 0.0 111.361 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 56' ' ' LEU . 2.7 pt? -85.64 119.29 25.81 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.498 0.666 . . . . 0.0 112.758 -176.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -114.18 94.36 4.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 166.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.573 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 65.5 mt -102.6 158.23 16.38 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -159.71 172.18 18.2 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.1 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.5 -82.91 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -117.59 8.67 12.93 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.113 0.482 . . . . 0.0 111.121 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.573 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 71.57 29.7 67.49 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.012 -174.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.731 ' H ' ' HD3' ' A' ' 107' ' ' PRO . 24.1 t -136.4 -22.1 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.453 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.731 ' HD3' ' H ' ' A' ' 106' ' ' VAL . 21.1 Cg_endo -90.25 50.2 1.03 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.697 1.598 . . . . 0.0 113.94 -163.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.591 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.0 OUTLIER -126.14 26.03 6.58 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -171.759 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.662 HD22 ' HB2' ' A' ' 43' ' ' GLN . 1.5 mp -100.65 -12.25 19.33 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.07 -9.17 46.55 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.389 177.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.23 -30.21 27.86 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.259 0.552 . . . . 0.0 111.198 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -100.56 -44.15 5.95 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.262 -172.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.28 -68.33 0.57 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.378 0.609 . . . . 0.0 111.051 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.176 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.441 HD23 ' N ' ' A' ' 115' ' ' LEU . 3.1 mm? -76.55 69.45 2.98 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.492 0.663 . . . . 0.0 110.323 179.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 . . . . . 0 CA--C 1.537 0.455 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.316 -174.611 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.537 0.208 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p -62.85 158.18 19.57 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.909 0.385 . . . . 0.0 111.538 174.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.63 144.08 29.13 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.069 0.461 . . . . 0.0 111.701 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 5.2 mt -107.14 146.0 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.405 178.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.423 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 34.3 m-85 -134.97 138.71 44.28 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -176.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.489 ' HZ2' ' CD ' ' A' ' 23' ' ' GLU . 67.2 tttt -151.18 122.65 7.89 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.982 0.42 . . . . 0.0 111.372 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.525 ' N ' HD13 ' A' ' 7' ' ' ILE . 3.3 mp -94.29 135.78 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.126 -178.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.461 ' N ' HD21 ' A' ' 8' ' ' LEU . 2.3 pt? -150.23 167.45 26.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.89 0.376 . . . . 0.0 111.093 178.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 t -71.1 149.34 46.57 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.728 0.299 . . . . 0.0 111.301 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.05 -38.91 71.25 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.875 0.369 . . . . 0.0 110.918 177.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.3 77.54 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.025 0.44 . . . . 0.0 111.699 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -69.7 -40.28 76.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.149 0.5 . . . . 0.0 111.164 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.474 ' NE1' ' HE3' ' A' ' 17' ' ' LYS . 22.1 t-105 -73.23 -46.13 51.97 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.891 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.16 -41.21 92.31 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.827 0.346 . . . . 0.0 110.965 176.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.36 82.03 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.165 0.507 . . . . 0.0 110.846 174.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.01 -47.55 84.78 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.147 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.474 ' HE3' ' NE1' ' A' ' 13' ' ' TRP . 96.2 mttt -60.06 -37.81 80.96 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.306 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.87 90.7 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.848 0.356 . . . . 0.0 111.807 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -94.92 -3.02 49.41 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.804 0.335 . . . . 0.0 111.812 178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.67 6.96 60.38 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.505 -0.379 . . . . 0.0 113.293 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.6 mtt180 -143.8 157.44 44.37 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 122.505 -0.409 . . . . 0.0 111.408 -175.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 23' ' ' GLU . 46.7 t80 -134.83 178.84 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 170.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.587 ' HB2' ' HA ' ' A' ' 87' ' ' PRO . 67.3 mm-40 92.45 156.12 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.246 1.019 . . . . 0.0 113.703 172.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.04 42.52 24.38 Favored Glycine 0 CA--C 1.526 0.751 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.548 -170.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.1 p -81.56 -176.63 6.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.713 0.292 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.55 -51.01 61.73 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.701 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 36.2 t -69.88 -51.17 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -54.72 -44.17 73.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.864 0.364 . . . . 0.0 111.669 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.13 -35.23 69.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.04 90.02 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.901 0.381 . . . . 0.0 111.408 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -69.84 -39.3 76.51 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.983 0.42 . . . . 0.0 111.07 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 129.41 -25.07 4.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.123 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -159.04 161.44 36.55 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.685 0.394 . . . . 0.0 110.663 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 23' ' ' GLU . 66.0 mt -61.82 140.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.143 0.497 . . . . 0.0 112.312 -173.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -139.32 105.97 5.36 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.053 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.487 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 3.8 mp -98.21 -175.41 3.11 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.515 175.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.5 m -131.97 155.37 48.09 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.22 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.31 173.23 12.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.657 174.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.92 -57.41 11.06 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.667 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.05 -42.79 99.8 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.122 0.486 . . . . 0.0 111.505 178.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -74.29 -15.1 60.98 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.914 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -70.85 -49.77 42.52 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.093 0.473 . . . . 0.0 110.686 176.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.5 -36.99 82.06 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.089 0.471 . . . . 0.0 110.639 174.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.1 -47.18 85.78 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.143 0.497 . . . . 0.0 110.873 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 92.7 m -61.55 -31.23 71.25 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.059 0.457 . . . . 0.0 110.811 175.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.59 -58.43 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.812 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.61 -30.56 55.08 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.982 0.42 . . . . 0.0 112.12 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -84.69 -49.24 8.68 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -116.55 -35.4 4.25 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.528 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 98.5 m-85 -114.06 59.08 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.612 0.72 . . . . 0.0 110.728 -176.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -72.0 -4.66 29.89 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.25 -0.886 . . . . 0.0 112.797 -174.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.57 -96.76 0.1 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.56 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.507 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.0 mt-30 59.79 -164.08 0.22 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.613 0.365 . . . . 0.0 111.651 -176.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.63 120.49 30.9 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.858 -0.526 . . . . 0.0 111.7 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 57.5 83.12 0.11 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.01 0.524 . . . . 0.0 112.185 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.507 HD21 ' HB2' ' A' ' 53' ' ' GLN . 79.6 mt -99.09 123.55 43.46 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.576 177.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.413 ' O ' HD21 ' A' ' 8' ' ' LEU . 48.4 t -87.73 127.62 40.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.573 ' HB2' HD13 ' A' ' 99' ' ' LEU . 67.4 tp -99.6 99.77 10.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.274 174.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 89.0 mt -75.61 107.72 7.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.751 177.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' A' ' 4' ' ' ILE . . . -117.29 114.05 23.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.601 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.448 HG12 HG23 ' A' ' 94' ' ' THR . 43.5 t -127.0 142.53 43.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.487 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.466 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 0.7 OUTLIER -69.86 133.81 47.78 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.456 175.261 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.6 30.54 0.24 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -174.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.413 ' C ' ' H ' ' A' ' 66' ' ' LEU . 0.4 OUTLIER -77.32 -41.59 2.41 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 122.039 -0.413 . . . . 0.0 111.772 174.575 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.466 ' HD2' ' O ' ' A' ' 62' ' ' GLU . 18.2 Cg_exo -70.27 39.21 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.591 2.194 . . . . 0.0 112.405 168.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 70' ' ' LEU . 48.8 tp -61.68 -41.93 98.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.565 0.746 . . . . 0.0 112.394 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 60.71 -114.87 7.02 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.171 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.9 10.61 0.47 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.365 0.602 . . . . 0.0 110.966 175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -102.16 -26.18 13.45 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.483 ' HB3' HD12 ' A' ' 66' ' ' LEU . 38.6 tp -70.5 96.77 1.21 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.438 0.637 . . . . 0.0 110.291 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HG2' ' HB2' ' A' ' 73' ' ' GLU . 39.1 ttmt -103.26 102.29 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.68 -175.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -70.42 98.14 1.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.561 ' HB2' ' HG2' ' A' ' 71' ' ' LYS . 9.7 tp10 -137.9 159.9 40.76 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.716 -169.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.37 179.15 4.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.071 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 88.5 p -134.6 -68.76 0.53 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.036 0.446 . . . . 0.0 111.346 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -106.42 -66.8 0.98 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.77 -107.2 0.63 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.295 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.61 -163.45 10.21 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.928 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 69.7 143.87 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.426 0.631 . . . . 0.0 112.43 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -100.27 117.79 35.21 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.056 0.455 . . . . 0.0 111.747 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -97.96 129.76 30.32 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.447 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.466 ' HB2' HD11 ' A' ' 70' ' ' LEU . 37.8 Cg_endo -66.83 103.93 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.117 1.878 . . . . 0.0 112.533 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 70' ' ' LEU . 74.6 m80 -96.51 154.29 17.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.078 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.0 mt -129.74 145.93 51.52 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 112.358 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -114.12 10.19 17.35 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.836 171.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -118.43 133.97 23.48 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.238 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.587 ' HA ' ' HB2' ' A' ' 23' ' ' GLU . 14.2 Cg_exo -68.51 136.81 37.61 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 121.601 1.534 . . . . 0.0 111.583 173.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.94 101.48 6.87 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.292 0.568 . . . . 0.0 111.707 -171.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.96 120.13 11.39 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.309 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 80.2 t -53.38 -36.14 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.067 0.46 . . . . 0.0 111.565 -177.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.3 t -60.07 -30.43 69.21 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -79.76 -20.23 46.8 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.832 0.349 . . . . 0.0 111.49 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.7 124.94 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 120.683 0.278 . . . . 0.0 111.668 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.448 HG23 HG12 ' A' ' 61' ' ' VAL . 82.6 p -77.18 -57.72 3.68 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 60' ' ' ALA . 6.7 ptp85 -131.54 145.41 51.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.144 0.497 . . . . 0.0 112.113 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -122.36 97.73 5.6 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.145 0.498 . . . . 0.0 111.037 176.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.525 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -82.75 118.49 23.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 111.648 -176.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -84.32 105.86 15.48 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.094 0.473 . . . . 0.0 110.486 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' ' 58' ' ' LEU . 73.2 mt -82.85 103.35 12.26 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.188 0.518 . . . . 0.0 112.386 -173.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -91.6 142.01 28.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.194 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.61 127.21 32.58 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -176.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -134.73 167.79 20.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.631 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.63 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 173.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -100.49 3.91 43.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.643 0.259 . . . . 0.0 111.664 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.51 22.55 72.56 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.136 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.9 t -123.14 136.34 26.88 Favored Pre-proline 0 N--CA 1.471 0.588 0 C-N-CA 123.248 0.619 . . . . 0.0 110.256 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.443 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 53.1 Cg_exo -54.35 117.68 4.2 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.676 2.251 . . . . 0.0 113.761 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -75.39 98.24 3.83 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.8 mp -100.43 -40.63 7.38 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.988 -0.445 . . . . 0.0 111.76 173.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.03 -42.9 31.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.617 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -89.56 -29.34 18.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -66.44 -33.3 75.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 59.8 mt -80.8 161.69 24.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.566 -178.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.92 -74.8 0.53 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.113 -176.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 56.2 tp 61.08 102.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.236 0.541 . . . . 0.0 111.4 -175.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 . . . . . 0 CA--C 1.537 0.447 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.374 -176.505 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.9 mtp . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.623 0.249 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.6 m -70.64 126.81 30.66 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.78 0.324 . . . . 0.0 111.817 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.8 mt -111.59 130.0 55.89 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.627 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.492 HG13 HD22 ' A' ' 36' ' ' LEU . 16.8 pt -114.32 132.22 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-O 121.335 0.588 . . . . 0.0 110.935 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.787 ' HB3' HD23 ' A' ' 58' ' ' LEU . 32.3 m-85 -107.6 135.2 49.45 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.015 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.604 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 50.0 tttm -120.8 124.23 44.55 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 122.355 -0.215 . . . . 0.0 111.207 175.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.54 ' N ' HD13 ' A' ' 7' ' ' ILE . 3.2 mp -93.23 136.91 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.477 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -153.87 174.01 15.15 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.023 0.44 . . . . 0.0 111.622 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -85.87 150.65 24.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.971 0.415 . . . . 0.0 111.41 175.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -34.14 70.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.01 0.433 . . . . 0.0 110.248 177.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.89 -39.55 85.71 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.444 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.47 ' OE1' ' HB2' ' A' ' 25' ' ' SER . 52.7 mt-10 -62.45 -53.32 56.54 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.341 0.591 . . . . 0.0 110.908 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.4 ' CH2' HG12 ' A' ' 90' ' ' VAL . 47.0 t-105 -60.91 -60.36 3.91 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.612 -174.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.529 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -61.18 -31.59 71.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.357 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -65.4 -59.16 4.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.011 0.434 . . . . 0.0 110.67 174.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.7 69.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.993 0.425 . . . . 0.0 111.808 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.529 ' HE2' ' HA ' ' A' ' 14' ' ' ASP . 37.2 ttpt -71.21 -26.69 63.05 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.931 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.56 -30.62 52.73 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.819 172.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 7.7 mm-40 -78.97 -29.63 44.01 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.934 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.52 -2.48 65.01 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.157 -0.474 . . . . 0.0 113.214 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 21' ' ' ARG . 10.3 ptm180 -148.21 125.24 11.36 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 122.404 -0.468 . . . . 0.0 111.925 -174.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.604 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 53.6 t80 -93.84 116.96 29.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.04 0.448 . . . . 0.0 110.505 176.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -109.96 9.96 24.32 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -174.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.95 175.6 20.93 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.844 -0.693 . . . . 0.0 114.551 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.47 ' HB2' ' OE1' ' A' ' 12' ' ' GLU . 38.8 t -128.52 -175.81 3.63 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.006 0.522 . . . . 0.0 110.889 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.46 -33.02 63.26 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -45.91 71.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.418 0.627 . . . . 0.0 111.051 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.508 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 14.7 m-20 -62.6 -38.6 90.8 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.898 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.55 -21.92 60.23 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.648 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.5 -39.98 85.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.053 0.454 . . . . 0.0 110.877 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.46 -59.4 2.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.368 0.604 . . . . 0.0 110.734 171.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 154.71 -49.32 0.49 Allowed Glycine 0 CA--C 1.525 0.68 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.737 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -128.93 169.43 14.65 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.607 0.363 . . . . 0.0 110.852 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.0 mt -54.59 134.06 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.824 0.345 . . . . 0.0 111.274 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.508 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 25.5 p80 -143.3 123.61 13.82 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.212 0.53 . . . . 0.0 111.761 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.597 ' HG ' ' HB2' ' A' ' 6' ' ' LYS . 5.0 mp -96.58 -163.06 1.01 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.676 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.9 p -137.76 150.09 46.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.837 0.351 . . . . 0.0 111.327 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -98.91 109.53 22.27 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -176.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.78 -103.78 0.26 Allowed Glycine 0 CA--C 1.53 1.002 0 N-CA-C 114.579 0.592 . . . . 0.0 114.579 173.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.06 -42.01 84.55 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.788 0.328 . . . . 0.0 111.642 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -53.21 -28.71 28.24 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.017 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.48 -56.56 13.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.486 178.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -61.43 -43.04 99.57 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.373 178.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.42 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 18.8 mm-40 -55.55 -57.0 13.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.943 177.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 84.6 m -57.3 -38.46 74.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.942 0.401 . . . . 0.0 111.363 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.15 83.38 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.966 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.86 -24.65 28.47 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 67.1 mttm -88.87 -59.01 2.34 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -97.18 -33.87 11.33 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -170.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -98.75 64.47 1.48 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.506 0.669 . . . . 0.0 110.853 -173.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' NE ' ' HA ' ' A' ' 51' ' ' ARG . 4.5 mmp_? -109.36 139.14 44.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.804 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.24 39.85 93.06 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 114.959 0.744 . . . . 0.0 114.959 174.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.523 ' HB2' HD23 ' A' ' 56' ' ' LEU . 45.0 mt-30 -116.14 142.74 46.42 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 117.351 0.576 . . . . 0.0 111.116 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.49 127.63 32.44 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 58.95 84.1 0.11 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.429 177.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.523 HD23 ' HB2' ' A' ' 53' ' ' GLN . 85.6 mt -101.65 134.96 43.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.274 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.8 t -113.09 152.96 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 110.928 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.787 HD23 ' HB3' ' A' ' 5' ' ' TYR . 3.2 tt -129.2 114.88 16.85 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.008 0.433 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.494 HD23 HG13 ' A' ' 93' ' ' VAL . 86.5 mt -90.83 107.22 19.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.996 0.426 . . . . 0.0 110.873 177.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -95.87 107.37 19.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.505 177.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.23 143.91 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.014 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -72.27 127.97 34.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 122.096 -0.377 . . . . 0.0 110.604 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.15 -47.91 71.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.037 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 63.38 161.86 0.12 Allowed Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.79 -62.15 0.23 Allowed 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.485 2.123 . . . . 0.0 112.963 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 19.0 66.03 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -44.46 130.95 7.38 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 115.067 -0.969 . . . . 0.0 114.918 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 78.66 -24.67 0.21 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -69.0 -42.29 76.67 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.648 -0.657 . . . . 0.0 111.053 172.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.99 143.3 32.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 111.01 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -153.61 132.08 12.11 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.809 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -77.84 64.05 3.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.701 0.762 . . . . 0.0 110.55 176.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -80.03 132.56 36.02 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.644 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -147.23 165.8 28.96 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.122 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 55.7 m -122.42 -178.08 3.8 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.779 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 75.18 -47.37 0.61 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 165.43 -34.42 0.25 Allowed Glycine 0 CA--C 1.524 0.624 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.689 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.22 -149.08 5.35 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.294 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 64.03 -175.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.124 0.488 . . . . 0.0 111.951 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.416 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 38.4 ptt180 -160.07 135.74 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.783 0.325 . . . . 0.0 111.369 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.412 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 92.3 m-85 -131.21 123.21 19.57 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 173.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.64 95.06 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 121.942 1.761 . . . . 0.0 112.637 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.412 ' HD2' ' O ' ' A' ' 81' ' ' PHE . 12.0 m170 -88.36 123.12 32.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.19 177.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -101.35 112.56 25.12 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.273 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -82.15 8.25 11.41 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -174.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -111.36 148.64 39.21 Favored Pre-proline 0 N--CA 1.473 0.689 0 O-C-N 122.034 -0.416 . . . . 0.0 110.904 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.66 109.47 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.022 1.815 . . . . 0.0 110.975 171.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.43 104.69 1.29 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.303 0.573 . . . . 0.0 110.825 -171.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.21 137.27 50.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.107 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.516 HG22 ' HA ' ' A' ' 17' ' ' LYS . 68.0 t -57.68 -34.73 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.8 m -69.46 -9.24 52.83 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.835 -0.621 . . . . 0.0 112.183 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -105.91 -6.99 18.44 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.926 0.393 . . . . 0.0 111.826 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.494 HG13 HD23 ' A' ' 59' ' ' LEU . 58.7 t -69.74 110.46 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 122.024 -0.422 . . . . 0.0 111.233 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.515 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 85.1 m -48.81 -58.52 4.68 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -147.78 138.42 23.18 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.358 0.599 . . . . 0.0 112.104 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.89 118.88 35.46 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.442 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.97 108.45 12.95 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 122.025 -0.422 . . . . 0.0 111.969 -178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.0 126.59 31.23 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.234 0.54 . . . . 0.0 110.866 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -83.87 111.1 18.92 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -74.85 -11.72 60.21 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 177.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.3 mt 65.64 -167.43 0.21 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.693 0.397 . . . . 0.0 111.261 -176.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -149.05 -172.85 4.22 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 122.289 -0.257 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -28.49 65.42 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.68 -3.63 58.74 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.148 0.499 . . . . 0.0 110.649 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.11 -6.83 61.79 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 116.057 -0.519 . . . . 0.0 112.989 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.98 133.34 39.41 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.669 -0.312 . . . . 0.0 111.344 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.96 118.63 5.66 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.158 1.905 . . . . 0.0 112.354 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -66.3 97.99 0.44 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.34 0.59 . . . . 0.0 112.186 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.1 mp -100.17 -15.78 18.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.948 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -53.84 -33.39 49.61 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.759 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -68.54 -37.04 79.62 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 122.799 0.44 . . . . 0.0 111.652 174.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -85.45 -30.17 23.73 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -173.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 40.0 mt -89.95 169.34 11.3 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.74 8.08 43.48 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.871 0.367 . . . . 0.0 111.843 178.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.471 ' N ' HD13 ' A' ' 115' ' ' LEU . 6.4 mp -80.6 105.51 11.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.812 0.339 . . . . 0.0 111.327 -178.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 121.555 0.693 . . . . 0.0 111.717 -176.977 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 mtt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.71 0.291 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.508 HG23 ' HB1' ' A' ' 63' ' ' ALA . 14.0 m -83.37 121.89 27.74 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -171.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.502 HD22 ' HA ' ' A' ' 62' ' ' GLU . 0.4 OUTLIER -128.46 132.0 48.39 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.931 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.563 HD13 HD21 ' A' ' 36' ' ' LEU . 14.1 pt -114.16 145.76 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 58' ' ' LEU . 77.9 m-85 -123.81 146.5 48.31 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.726 -176.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.686 ' HB3' ' HZ1' ' A' ' 6' ' ' LYS . 6.4 ttpm? -156.35 125.28 5.99 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.252 -0.28 . . . . 0.0 111.433 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 55.6 mt -94.91 135.94 27.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 120.797 0.332 . . . . 0.0 111.808 -178.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -143.79 172.03 13.4 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.624 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.6 m -76.0 142.57 41.85 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.852 0.358 . . . . 0.0 111.587 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -55.94 -44.17 78.12 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.56 80.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.15 0.5 . . . . 0.0 112.127 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -69.42 -43.25 73.76 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.039 0.447 . . . . 0.0 110.95 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.6 t-105 -66.54 -34.75 78.6 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.628 177.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.531 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 24.4 t70 -60.04 -52.08 66.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.338 0.589 . . . . 0.0 110.432 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -55.32 -39.99 70.62 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.105 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . . . -59.82 -45.77 91.31 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.397 175.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.62 ' HZ2' ' HB2' ' A' ' 17' ' ' LYS . 10.5 mtmp? -61.0 -36.0 78.33 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.859 0.361 . . . . 0.0 111.054 176.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -42.41 98.99 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.136 0.494 . . . . 0.0 111.129 174.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 77.0 mm-40 -70.74 -26.61 63.45 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.223 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.5 -1.51 61.1 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.406 -0.426 . . . . 0.0 112.405 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -150.77 134.57 16.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.099 0.56 . . . . 0.0 110.346 -173.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' ' HB3' ' A' ' 16' ' ' ALA . 90.1 t80 -134.9 130.25 35.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.85 0.357 . . . . 0.0 111.55 -176.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.664 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 1.7 pm0 -100.69 -75.19 0.59 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.294 175.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.664 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . -157.88 -123.62 0.75 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.717 -176.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.2 t -175.69 -164.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.583 -0.363 . . . . 0.0 111.1 -173.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.89 -63.29 1.23 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.6 p -55.8 -40.33 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-O 121.119 0.485 . . . . 0.0 111.509 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -54.68 44.02 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.426 177.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.09 -13.4 61.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.04 -54.66 23.09 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.753 0.311 . . . . 0.0 110.614 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.42 -42.19 25.99 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.655 0.264 . . . . 0.0 111.229 174.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.42 13.42 7.51 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 170.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -148.41 139.27 23.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.852 0.826 . . . . 0.0 112.292 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mt -65.02 87.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.481 0.658 . . . . 0.0 111.157 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -93.29 112.07 23.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.563 HD21 HD13 ' A' ' 4' ' ' ILE . 4.8 mp -94.71 -160.65 0.79 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.667 176.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.5 p -142.88 153.03 42.73 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.867 0.365 . . . . 0.0 111.0 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.22 178.82 5.49 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.851 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.65 -67.56 2.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.035 -0.603 . . . . 0.0 113.653 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 3.3 mp0 -56.08 -42.77 77.22 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 122.642 -0.328 . . . . 0.0 111.12 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.481 ' NE2' ' HB1' ' A' ' 79' ' ' ALA . 82.8 mt-30 -56.56 -44.06 80.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.834 0.35 . . . . 0.0 111.428 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.41 95.96 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.995 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.586 ' HB2' HD11 ' A' ' 109' ' ' LEU . 34.2 tt0 -64.1 -37.98 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.605 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.8 mt-10 -62.51 -51.77 66.12 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.877 0.37 . . . . 0.0 110.956 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 63.9 m -60.84 -35.27 76.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.027 0.442 . . . . 0.0 110.886 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.492 ' HB1' ' HG3' ' A' ' 107' ' ' PRO . . . -67.85 -48.82 65.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.743 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.7 -14.82 55.68 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.073 0.463 . . . . 0.0 111.606 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -98.98 -63.05 1.16 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.412 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -84.9 -49.06 8.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.165 0.507 . . . . 0.0 112.136 -176.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -97.42 56.1 1.31 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.961 0.41 . . . . 0.0 111.469 -173.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.85 -33.95 38.52 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 170.77 44.99 0.03 OUTLIER Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.11 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.516 ' HB2' HD22 ' A' ' 56' ' ' LEU . 85.2 mt-30 -79.06 133.47 36.79 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.896 0.379 . . . . 0.0 111.713 -174.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.93 61.41 5.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.131 0.491 . . . . 0.0 112.154 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -171.79 29.9 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.439 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 53' ' ' GLN . 22.3 mt -106.56 141.77 37.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.403 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 88.1 t -125.88 117.55 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.548 174.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.519 ' HB3' ' HB1' ' A' ' 97' ' ' ALA . 66.0 tp -93.14 100.08 12.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.707 178.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.6 mt -75.81 109.35 9.35 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.719 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.4 ' HB2' ' HB3' ' A' ' 95' ' ' ARG . . . -99.57 112.04 24.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 175.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.1 t -120.72 138.33 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 121.008 0.433 . . . . 0.0 112.148 -175.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.502 ' HA ' HD22 ' A' ' 3' ' ' LEU . 9.0 pt-20 -69.23 108.4 3.63 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.722 0.772 . . . . 0.0 110.281 175.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.508 ' HB1' HG23 ' A' ' 2' ' ' THR . . . -85.69 1.56 48.9 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -169.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.539 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 39.8 mt-10 -80.76 -49.94 1.06 Allowed Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 76.0 Cg_exo -52.5 -48.63 20.9 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 122.336 2.024 . . . . 0.0 113.06 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 pp -92.79 10.79 29.4 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -57.78 -28.29 60.16 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 114.652 0.621 . . . . 0.0 114.652 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -66.31 -26.44 67.31 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.361 0.581 . . . . 0.0 111.533 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.37 11.84 30.48 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.259 177.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 82' ' ' PRO . 42.0 tp -113.69 102.97 10.76 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.36 107.32 19.07 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 59.9 m95 -69.39 84.57 0.4 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.793 0.806 . . . . 0.0 109.489 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -119.85 120.49 36.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.287 -167.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.12 89.26 1.14 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.02 0.438 . . . . 0.0 111.409 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.5 p -75.2 78.89 2.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.685 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 63.37 178.52 0.16 Allowed 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.498 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.65 -66.93 2.66 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.97 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.58 -19.84 2.03 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.794 -178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.481 ' HB1' ' NE2' ' A' ' 41' ' ' GLN . . . -83.84 129.18 34.94 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.209 0.528 . . . . 0.0 112.006 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.3 mtp85 -70.85 104.35 2.89 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.478 176.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -94.4 123.27 59.09 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 120.802 0.334 . . . . 0.0 111.419 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.531 ' HB2' HD11 ' A' ' 70' ' ' LEU . 40.9 Cg_endo -67.42 109.15 1.74 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.531 2.154 . . . . 0.0 112.385 177.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -100.02 106.51 18.28 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.403 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.8 tp -93.5 138.67 31.56 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.97 0.414 . . . . 0.0 111.123 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.93 29.81 7.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 28.7 mmt180 -138.11 141.15 31.15 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 122.538 0.335 . . . . 0.0 111.711 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.97 120.36 7.58 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.769 2.312 . . . . 0.0 112.298 177.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 62.7 tp -81.23 110.86 17.1 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.063 0.459 . . . . 0.0 111.527 -177.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.28 136.26 53.22 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.215 -0.303 . . . . 0.0 110.448 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.521 HG22 ' HA ' ' A' ' 17' ' ' LYS . 91.4 t -58.37 -41.17 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.247 0.546 . . . . 0.0 110.935 178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.2 t -70.94 -10.08 59.03 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.828 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -95.73 -15.0 22.91 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.975 0.417 . . . . 0.0 111.333 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.25 145.0 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.968 0.413 . . . . 0.0 111.285 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.1 m -80.26 -50.77 9.76 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.909 0.385 . . . . 0.0 111.298 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 tpp180 -150.14 143.95 25.38 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.271 0.558 . . . . 0.0 111.788 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 9.1 pt-20 -116.41 98.76 6.75 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.081 173.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.519 ' HB1' ' HB3' ' A' ' 58' ' ' LEU . . . -89.09 87.36 7.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.165 0.507 . . . . 0.0 111.72 -176.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -67.95 103.93 1.6 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.333 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.3 tp 60.11 101.64 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.026 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.522 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 13.8 t70 -119.51 89.86 3.21 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.043 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.49 164.04 22.79 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 0.0 112.094 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.859 ' HB2' ' HB2' ' A' ' 108' ' ' GLN . 5.9 t70 -111.74 -169.41 1.46 Allowed 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.019 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.14 -25.75 61.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -89.41 0.93 56.49 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 75.96 5.56 80.36 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.69 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.4 t -89.45 135.8 30.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 122.32 0.248 . . . . 0.0 110.509 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.522 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 20.4 Cg_endo -59.44 95.95 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.289 1.993 . . . . 0.0 111.586 175.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.859 ' HB2' ' HB2' ' A' ' 102' ' ' ASP . 2.6 tp-100 -83.83 44.53 1.0 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.732 0.777 . . . . 0.0 110.699 -174.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.12 5.82 0.32 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.145 -0.934 . . . . 0.0 113.186 -176.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.95 -34.95 31.46 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.688 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -65.08 -27.63 68.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.034 0.445 . . . . 0.0 111.281 174.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -80.26 -24.2 40.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 120.973 0.416 . . . . 0.0 110.745 173.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.5 mt -105.59 -159.22 0.7 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.77 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -145.82 -28.71 0.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.54 142.85 38.81 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 176.291 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.805 0.336 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.0 m -74.54 -21.22 59.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -177.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.37 99.43 4.13 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.948 0.404 . . . . 0.0 111.714 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.463 HD13 HD12 ' A' ' 36' ' ' LEU . 15.4 pt -104.86 142.66 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 110.69 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -125.19 152.22 44.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.225 0.536 . . . . 0.0 112.098 -172.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HZ3' ' CG ' ' A' ' 28' ' ' ASP . 62.6 tttp -147.54 106.66 3.86 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.613 175.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -91.51 137.62 21.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.229 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.18 172.62 17.29 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.001 0.429 . . . . 0.0 111.268 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 94.4 p -76.24 146.4 39.05 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.054 0.454 . . . . 0.0 111.43 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -41.92 62.07 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.555 -179.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.46 -51.07 71.46 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.81 -29.48 69.96 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.028 0.442 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -70.23 -44.69 68.04 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.143 175.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -33.38 72.93 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.221 -0.3 . . . . 0.0 111.114 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.53 -40.96 88.9 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.853 175.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.58 79.52 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.379 174.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -58.6 -37.19 75.29 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.066 0.46 . . . . 0.0 111.211 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.73 -52.77 61.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.687 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 11.5 pt20 -77.24 -10.47 59.44 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 81.41 -45.14 3.18 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-O 121.354 0.419 . . . . 0.0 112.678 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -94.17 -173.93 3.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.451 0.643 . . . . 0.0 111.208 175.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -141.23 94.68 2.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.581 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -72.42 -20.91 61.34 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.91 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.85 152.89 6.67 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.043 -0.526 . . . . 0.0 113.073 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 86.2 p -91.12 -171.66 3.05 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.97 -53.57 15.63 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 64.0 t -59.88 -53.75 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.526 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 12.9 m-20 -57.96 -47.5 82.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.237 0.541 . . . . 0.0 111.713 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.89 -16.81 62.71 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.697 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -55.66 7.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -79.03 -51.59 9.38 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.44 -34.23 0.59 Allowed Glycine 0 CA--C 1.529 0.926 0 C-N-CA 120.298 -0.953 . . . . 0.0 114.561 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -131.1 157.08 44.07 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 117.455 0.627 . . . . 0.0 111.94 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.734 HD11 HD12 ' A' ' 88' ' ' LEU . 66.9 mt -70.58 114.83 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.577 0.703 . . . . 0.0 111.989 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -81.43 124.62 29.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.845 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.463 HD12 HD13 ' A' ' 4' ' ' ILE . 81.6 mt -109.82 111.31 22.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.702 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -77.85 105.85 9.31 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.288 0.566 . . . . 0.0 111.917 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.91 101.92 3.94 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.95 -95.99 0.01 OUTLIER Glycine 0 CA--C 1.532 1.098 0 N-CA-C 114.706 0.643 . . . . 0.0 114.706 173.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.39 -43.48 61.93 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.287 0.565 . . . . 0.0 111.366 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.13 -37.08 85.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.173 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.08 -44.66 97.03 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.628 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -67.0 -36.9 83.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.26 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.38 -56.7 17.4 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.912 0.386 . . . . 0.0 110.805 175.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.9 m -57.59 -38.56 75.07 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 111.377 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.797 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -68.34 -39.14 82.02 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.68 -19.25 60.34 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 111.712 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -93.2 -57.88 2.48 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.102 0.477 . . . . 0.0 111.565 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.71 -55.72 3.84 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -92.29 17.75 9.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -171.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -64.97 113.76 4.09 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.934 0.397 . . . . 0.0 111.428 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.77 25.96 73.96 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 114.237 0.455 . . . . 0.0 114.237 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -99.97 163.46 12.43 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 117.352 0.576 . . . . 0.0 111.451 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -109.21 174.18 5.98 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.862 -179.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 62.52 26.01 15.47 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.841 0.456 . . . . 0.0 112.029 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -88.47 111.48 21.86 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.75 135.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 121.006 0.431 . . . . 0.0 110.455 174.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 tt -102.25 106.23 17.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.037 0.446 . . . . 0.0 110.465 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.476 HD21 HG21 ' A' ' 93' ' ' VAL . 61.3 mt -84.97 107.29 17.03 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.691 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.504 ' HB1' ' HB3' ' A' ' 95' ' ' ARG . . . -102.96 117.86 35.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.743 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 4' ' ' ILE . 53.4 t -117.57 116.24 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.518 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.62 95.77 0.89 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -42.53 -65.65 0.45 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -170.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 64.75 158.35 0.12 Allowed Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 120.789 0.328 . . . . 0.0 110.976 -173.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 57.36 3.4 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.234 1.956 . . . . 0.0 112.809 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.581 HD11 ' N ' ' A' ' 67' ' ' GLY . 1.6 pp -67.32 -28.88 68.35 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.581 ' N ' HD11 ' A' ' 66' ' ' LEU . . . 176.35 154.08 11.31 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.741 -179.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.51 -23.89 67.58 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.118 0.485 . . . . 0.0 111.438 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -65.71 -9.54 28.76 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.107 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 84' ' ' LEU . 57.8 tp -98.54 100.89 12.17 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 168.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -116.36 133.47 55.99 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.094 0.473 . . . . 0.0 112.067 -176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -73.97 91.51 2.03 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.33 0.586 . . . . 0.0 110.259 172.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.31 143.08 35.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.173 -174.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -115.2 91.85 3.74 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 174.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.3 m -69.7 168.39 15.03 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.859 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.0 tpp85 -58.19 95.64 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.089 0.471 . . . . 0.0 111.354 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.87 -73.25 0.26 Allowed Glycine 0 CA--C 1.527 0.81 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.227 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 168.3 -158.26 30.89 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.364 -0.446 . . . . 0.0 113.015 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 62.29 -173.22 0.15 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -126.69 128.03 46.06 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.733 178.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -121.64 94.72 48.36 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.576 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.14 103.18 0.73 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.018 1.812 . . . . 0.0 112.226 178.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -101.41 115.52 30.7 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.336 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' A' ' 70' ' ' LEU . 30.2 tp -96.32 108.21 20.68 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.05 0.452 . . . . 0.0 109.938 175.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -81.0 55.32 2.44 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 120.891 0.377 . . . . 0.0 111.585 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -141.12 161.44 53.4 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.17 103.64 1.45 Allowed 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.532 2.155 . . . . 0.0 110.963 163.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.734 HD12 HD11 ' A' ' 34' ' ' ILE . 10.0 mp -75.71 122.86 24.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -169.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.1 mt -71.94 106.73 4.35 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.832 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 90' ' ' VAL . 42.3 t 54.14 39.1 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-O 122.2 1.0 . . . . 0.0 109.408 -171.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.716 ' HB2' HG22 ' A' ' 93' ' ' VAL . 70.9 m 56.5 19.85 4.44 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.36 -174.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 46.17 36.17 3.03 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.069 0.938 . . . . 0.0 110.813 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.716 HG22 ' HB2' ' A' ' 91' ' ' SER . 10.7 t -68.07 104.16 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.833 -176.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 70.0 m -74.73 -49.63 20.38 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.37 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.504 ' HB3' ' HB1' ' A' ' 60' ' ' ALA . 13.0 ttm180 -115.52 138.95 50.51 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.302 0.572 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -132.0 123.5 27.44 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.12 -176.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -147.31 146.75 29.82 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.47 131.81 39.25 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.213 174.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.64 HD11 ' HB3' ' A' ' 107' ' ' PRO . 53.9 tp -63.97 128.2 34.77 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -173.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -91.96 112.39 24.3 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.679 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.8 mt -94.75 160.61 14.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.625 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -102.91 -171.44 1.95 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 111.605 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.01 15.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -111.55 -13.18 13.86 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.46 14.06 36.47 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.656 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.57 124.72 43.37 Favored Pre-proline 0 CA--C 1.541 0.625 0 O-C-N 122.647 -0.326 . . . . 0.0 111.279 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.797 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 53.0 Cg_exo -55.71 114.85 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.862 2.374 . . . . 0.0 113.177 177.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -75.61 84.9 2.65 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.347 0.594 . . . . 0.0 112.163 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.406 HD23 ' HB2' ' A' ' 42' ' ' ALA . 4.3 mp -81.7 -11.55 59.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.52 174.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -54.79 -33.15 55.58 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.822 176.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.93 -27.73 63.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.15 0.5 . . . . 0.0 110.935 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -79.16 -44.86 21.09 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.235 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.6 mt -78.01 162.29 26.85 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.595 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.5 100.53 2.75 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.14 127.92 34.19 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.876 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.887 0.375 . . . . 0.0 111.427 -179.656 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.9 mtt . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.8 p -88.2 177.52 6.87 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.894 0.378 . . . . 0.0 111.53 178.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.07 134.58 38.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.85 0.357 . . . . 0.0 111.675 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.462 HG23 ' HB2' ' A' ' 63' ' ' ALA . 22.5 pt -116.39 143.65 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.811 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 58.1 m-85 -126.24 135.63 51.82 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.965 0.412 . . . . 0.0 112.061 -175.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -134.44 115.01 13.49 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.373 173.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.8 mt -90.56 131.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.735 0.302 . . . . 0.0 110.778 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.407 ' N ' HD21 ' A' ' 8' ' ' LEU . 1.9 pt? -147.61 161.2 41.63 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.034 0.445 . . . . 0.0 111.465 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.7 p -69.92 155.66 40.24 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.17 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.9 tpt85 -55.61 -33.3 63.85 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.93 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.81 -56.24 21.51 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.904 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -52.88 -47.58 67.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.244 0.545 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -70.43 -41.35 73.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.313 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.99 -52.67 58.51 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 110.735 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.62 -50.76 64.97 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.007 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 22' ' ' PHE . . . -58.46 -43.24 88.79 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.527 177.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -61.56 -39.66 91.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.936 0.398 . . . . 0.0 111.257 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.96 -33.59 65.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 176.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -74.97 -24.23 58.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.514 176.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.56 -10.43 61.91 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.523 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -159.08 141.51 13.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.519 . . . . 0.0 112.403 -178.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.518 ' CZ ' HD21 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -120.32 116.09 24.85 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.402 0.62 . . . . 0.0 111.573 173.411 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 87' ' ' PRO . 10.1 pt-20 -76.64 2.47 14.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.891 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 129.32 166.39 11.9 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.881 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 51.3 m -75.97 176.5 7.84 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.732 -0.275 . . . . 0.0 110.744 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.6 -52.66 63.03 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.035 0.445 . . . . 0.0 111.223 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.52 -50.21 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.286 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 2.4 m-20 -52.46 -60.53 3.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.95 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.49 -28.15 66.78 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.218 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.45 -46.25 70.32 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -88.45 -32.21 18.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.92 -66.25 0.31 Allowed Glycine 0 CA--C 1.526 0.773 0 C-N-CA 120.17 -1.014 . . . . 0.0 114.513 174.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -111.66 162.44 15.19 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.383 0.611 . . . . 0.0 112.256 -172.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.551 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 61.3 mt -66.78 136.27 27.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.606 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.405 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 12.4 m-70 -92.14 120.17 32.48 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.012 0.435 . . . . 0.0 111.794 -178.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.691 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 67.1 mt -116.83 169.16 9.6 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.183 175.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.0 m -139.56 154.96 47.75 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.081 0.467 . . . . 0.0 111.712 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.23 113.61 25.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.483 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.3 -107.09 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 114.343 0.497 . . . . 0.0 114.343 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -50.02 -47.08 53.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.043 0.537 . . . . 0.0 112.439 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -57.25 -25.63 59.47 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.34 -49.07 46.12 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 111.002 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.565 ' HB2' HD12 ' A' ' 109' ' ' LEU . 55.8 tt0 -65.85 -36.76 84.35 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.021 0.439 . . . . 0.0 110.856 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.98 -52.61 64.27 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.064 174.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.5 m -57.84 -33.33 68.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.807 0.336 . . . . 0.0 111.128 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.03 -54.48 45.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.902 0.382 . . . . 0.0 110.87 174.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.17 -30.32 69.26 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.024 0.44 . . . . 0.0 111.978 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -76.81 -46.79 23.61 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -110.36 -57.56 2.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.406 0.622 . . . . 0.0 112.385 -174.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.52 ' HB3' HD12 ' A' ' 56' ' ' LEU . 74.6 m-85 -95.2 60.65 2.34 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.423 0.63 . . . . 0.0 111.275 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -73.05 -34.54 66.35 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -174.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 176.91 65.88 0.06 OUTLIER Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.528 -0.844 . . . . 0.0 113.815 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.57 24.63 10.82 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.54 -0.388 . . . . 0.0 111.815 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 55.48 120.85 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.2 m120 64.74 89.44 0.09 Allowed 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.678 0.752 . . . . 0.0 111.809 -176.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.52 HD12 ' HB3' ' A' ' 50' ' ' PHE . 58.5 mt -121.24 111.35 17.27 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.779 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 55.4 t -84.99 128.88 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.329 0.585 . . . . 0.0 112.475 -171.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.529 ' HB2' HD13 ' A' ' 99' ' ' LEU . 66.5 tp -97.06 115.1 26.88 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.239 172.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 83.8 mt -88.89 107.74 19.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 0.0 110.971 176.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.14 100.67 10.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.596 178.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.488 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 48.3 t -114.69 132.35 64.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.722 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.9 92.43 1.26 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 171.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -45.06 -66.78 0.35 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -163.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.8 mm-40 68.69 157.43 0.15 Allowed Pre-proline 0 N--CA 1.473 0.682 0 CA-C-O 121.094 0.473 . . . . 0.0 111.129 -168.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -59.06 -41.34 62.03 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.929 1.752 . . . . 0.0 112.194 171.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.3 mt 70.81 -53.12 0.67 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.946 0.898 . . . . 0.0 111.002 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.17 -77.61 0.05 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.83 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -141.93 7.19 1.83 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 123.16 0.584 . . . . 0.0 110.695 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.54 ' OD2' ' HG3' ' A' ' 86' ' ' ARG . 4.7 m-20 -67.95 -52.1 39.91 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -164.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.8 tp -69.27 97.92 0.99 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.712 0.768 . . . . 0.0 111.419 -170.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -99.23 105.15 17.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.222 -177.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -75.06 101.67 4.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.201 0.524 . . . . 0.0 110.639 176.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.97 102.44 2.41 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.608 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -108.24 86.09 2.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.063 0.459 . . . . 0.0 110.808 175.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -110.54 -150.96 0.47 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.058 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.4 mtm180 -67.54 79.34 0.17 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.308 0.575 . . . . 0.0 110.854 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.47 160.23 22.23 Favored Glycine 0 CA--C 1.525 0.694 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.711 -178.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.87 -34.33 21.92 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.699 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -83.37 132.5 34.99 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 122.433 -0.451 . . . . 0.0 112.055 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -89.42 116.59 27.72 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.828 0.347 . . . . 0.0 110.773 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -98.99 112.33 62.72 Favored Pre-proline 0 N--CA 1.472 0.666 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.691 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 17.6 Cg_exo -66.41 135.5 39.77 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.528 2.152 . . . . 0.0 113.404 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -121.44 154.45 36.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.475 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.551 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 23.8 tp -123.09 140.81 52.64 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.568 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -82.17 -62.46 1.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.54 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 13.0 mtm-85 -71.87 155.76 91.73 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -174.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.538 ' HA ' ' HA ' ' A' ' 23' ' ' GLU . 51.9 Cg_exo -56.76 115.8 2.74 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.313 2.009 . . . . 0.0 111.516 168.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.518 HD21 ' CZ ' ' A' ' 22' ' ' PHE . 2.5 tt -64.83 116.6 6.49 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 111.715 -171.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.1 mt -78.64 128.96 34.19 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.049 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.52 -33.76 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-O 120.764 0.316 . . . . 0.0 111.483 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 63.7 p -65.46 -28.09 68.97 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.847 0.356 . . . . 0.0 111.603 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.57 -20.11 58.84 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.03 119.42 17.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.949 175.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.488 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 57.0 p -74.93 -63.7 1.2 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -120.45 142.86 48.86 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.613 0.72 . . . . 0.0 112.914 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -132.55 148.59 52.38 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.32 176.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.53 138.79 15.68 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -84.14 127.57 34.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.89 0.376 . . . . 0.0 110.389 177.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.529 HD13 ' HB2' ' A' ' 58' ' ' LEU . 94.6 mt -91.62 119.26 31.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.122 0.487 . . . . 0.0 112.223 -176.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.58 154.5 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.02 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.484 ' HB3' ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -150.07 149.81 30.84 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.201 0.525 . . . . 0.0 112.183 -176.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -100.48 -172.53 2.22 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.631 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.4 7.84 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.04 -10.74 52.3 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.242 0.544 . . . . 0.0 110.204 177.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.5 36.6 58.88 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.79 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 72.5 t -139.44 116.96 8.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.484 ' HA ' ' HB3' ' A' ' 101' ' ' LEU . 36.5 Cg_endo -66.52 98.85 0.41 Allowed 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 121.951 1.767 . . . . 0.0 110.681 167.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -74.84 84.35 2.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.6 0.714 . . . . 0.0 112.44 -169.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.565 HD12 ' HB2' ' A' ' 43' ' ' GLN . 2.2 pp -96.08 5.68 50.57 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.821 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.55 -24.44 56.53 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.436 -0.412 . . . . 0.0 113.639 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -77.56 -11.39 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.147 0.499 . . . . 0.0 111.353 174.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -98.98 -47.64 5.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.179 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.72 166.66 11.38 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -176.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 57.59 93.52 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.335 0.588 . . . . 0.0 111.5 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.5 tp -90.58 137.07 32.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.11 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 121.029 0.442 . . . . 0.0 110.872 174.025 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.0 p -79.17 154.6 29.16 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.894 0.378 . . . . 0.0 111.025 175.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.1 mt -112.96 130.95 55.94 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.962 0.41 . . . . 0.0 111.66 -177.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.433 HG22 HD21 ' A' ' 70' ' ' LEU . 24.0 pt -105.01 146.17 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.723 174.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.451 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 44.1 m-85 -129.85 164.23 24.58 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.247 0.546 . . . . 0.0 112.148 -172.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HE2' ' HG ' ' A' ' 36' ' ' LEU . 24.5 ttmm -156.52 106.76 2.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.809 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.1 mt -88.89 135.9 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.945 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 8' ' ' LEU . 2.0 pt? -152.24 166.93 30.23 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.952 0.406 . . . . 0.0 111.305 -177.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 t -75.68 150.48 37.9 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.858 0.361 . . . . 0.0 111.096 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.526 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . 8.7 tpt180 -56.82 -35.67 69.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.043 0.449 . . . . 0.0 110.839 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.71 -37.47 73.57 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.373 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -75.88 -38.84 57.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.122 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -69.15 -48.43 62.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.33 -37.67 84.13 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.207 -0.308 . . . . 0.0 111.587 175.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.47 -45.29 92.05 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.064 0.459 . . . . 0.0 110.648 174.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.7 -53.02 62.94 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.563 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HZ2' ' HB2' ' A' ' 17' ' ' LYS . 10.1 mtmp? -61.84 -27.57 68.87 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.887 0.375 . . . . 0.0 111.66 179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.63 -51.36 51.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.957 0.408 . . . . 0.0 111.403 176.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -87.88 3.27 49.08 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.85 -1.01 48.79 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.502 -0.38 . . . . 0.0 114.034 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -149.14 149.21 30.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 122.406 -0.467 . . . . 0.0 111.513 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -110.42 132.87 53.8 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.46 0.648 . . . . 0.0 111.872 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -106.61 130.57 54.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.087 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -47.75 -71.28 0.58 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.52 0.568 . . . . 0.0 114.52 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.539 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 44.3 t 179.4 159.34 0.68 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.713 0.405 . . . . 0.0 110.143 -178.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -55.19 35.45 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.3 p -63.15 -33.32 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 111.813 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.539 ' HB2' ' HB3' ' A' ' 25' ' ' SER . 22.1 t0 -62.1 -58.44 7.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.251 0.548 . . . . 0.0 110.481 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.97 -33.83 76.61 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.04 -37.95 89.31 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -75.99 -34.57 59.75 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.755 0.312 . . . . 0.0 110.771 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 165.12 -68.86 0.2 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 120.151 -1.023 . . . . 0.0 114.566 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.55 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 52.9 m-85 -145.45 141.84 28.73 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 122.42 -0.459 . . . . 0.0 111.738 -167.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 62.1 mt -50.96 107.09 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -80.53 127.93 33.01 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.281 0.562 . . . . 0.0 111.474 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.496 ' HG ' ' HE2' ' A' ' 6' ' ' LYS . 7.3 mp -91.32 -46.33 8.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.5 m 66.5 97.06 0.05 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.158 0.504 . . . . 0.0 110.973 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.52 155.92 19.1 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.74 -119.92 18.92 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.721 -0.672 . . . . 0.0 113.939 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -59.74 -40.0 86.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.118 0.485 . . . . 0.0 110.994 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -67.39 -29.13 68.56 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.141 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.19 -50.87 59.39 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.138 0.494 . . . . 0.0 110.895 176.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -57.41 -47.52 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.251 175.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 33.1 tt0 -61.35 -48.36 81.64 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.302 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -60.82 -37.86 83.43 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 120.952 0.405 . . . . 0.0 111.162 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.43 -40.84 83.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.74 175.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.12 -25.62 61.8 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.024 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 65.1 mttm -74.78 -69.43 0.46 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.39 0.614 . . . . 0.0 111.669 177.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.3 m0 -75.0 -60.68 2.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.503 -0.771 . . . . 0.0 112.4 -170.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.524 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 45.0 m-85 -82.92 -66.33 0.9 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.575 -170.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 70.81 -65.54 0.33 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -151.48 56.19 0.45 Allowed Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.57 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.551 ' HB2' HD22 ' A' ' 56' ' ' LEU . 78.6 mt-30 -99.81 -164.66 1.14 Allowed 'General case' 0 CA--C 1.539 0.544 0 O-C-N 122.774 -0.251 . . . . 0.0 110.834 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.67 -67.19 0.89 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 15.4 p-10 -97.33 67.7 2.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.857 0.837 . . . . 0.0 111.728 -168.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.551 HD22 ' HB2' ' A' ' 53' ' ' GLN . 37.7 mt -94.71 124.78 38.95 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.542 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 t -110.65 148.64 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.26 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.0 tt -122.27 118.77 29.33 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.824 0.345 . . . . 0.0 110.799 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.6 mt -90.85 131.56 36.41 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.56 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -128.53 125.08 37.59 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.904 0.383 . . . . 0.0 111.519 -178.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.99 134.5 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 120.869 0.366 . . . . 0.0 111.128 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -74.53 138.4 43.09 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 175.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.418 ' O ' ' HG ' ' A' ' 66' ' ' LEU . . . -48.39 -70.51 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.491 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 28.2 mt-10 61.24 167.98 0.09 OUTLIER Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.491 ' HD2' ' HB3' ' A' ' 64' ' ' GLU . 82.8 Cg_exo -52.24 5.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.503 0 C-N-CA 123.711 2.941 . . . . 0.0 116.356 176.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 63' ' ' ALA . 4.3 pp -88.35 10.34 20.23 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.315 -0.865 . . . . 0.0 111.656 178.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -71.83 27.13 0.63 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.504 0.562 . . . . 0.0 114.504 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.17 -35.4 9.67 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.23 -0.571 . . . . 0.0 110.247 173.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -78.76 -12.69 60.03 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.13 175.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.433 HD21 HG22 ' A' ' 4' ' ' ILE . 51.5 tp -114.0 134.19 55.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.814 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -137.25 134.57 36.33 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.966 0.413 . . . . 0.0 111.416 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 73.0 m95 -83.66 89.41 7.12 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.97 0.414 . . . . 0.0 110.721 177.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.39 117.6 31.2 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.097 0.475 . . . . 0.0 112.131 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.424 ' HB3' ' HG2' ' A' ' 80' ' ' ARG . . . -89.49 114.12 25.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.037 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.3 m -117.78 36.24 4.38 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -164.26 -36.38 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 0.0 111.657 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 141.17 100.58 0.42 Allowed Glycine 0 CA--C 1.526 0.723 0 C-N-CA 121.182 -0.533 . . . . 0.0 113.038 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.8 -47.05 3.72 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.18 104.45 1.82 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 122.414 -0.463 . . . . 0.0 111.484 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.482 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 50.4 mtm180 -92.9 107.82 19.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.962 0.411 . . . . 0.0 111.365 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -84.31 114.68 56.25 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.408 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.51 111.45 1.66 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.406 2.071 . . . . 0.0 112.245 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 57.8 m170 -106.6 133.93 50.52 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.589 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.8 tp -100.22 120.42 39.87 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.924 0.392 . . . . 0.0 110.293 177.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -79.52 7.09 8.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -174.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -145.43 155.43 53.64 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 122.357 -0.214 . . . . 0.0 111.116 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.31 135.75 61.06 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.683 2.256 . . . . 0.0 113.072 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 61.5 tp -80.49 88.72 5.62 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.053 0.454 . . . . 0.0 111.232 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.2 mt -61.36 141.84 57.33 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.282 -0.261 . . . . 0.0 110.532 176.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 87.9 t -58.17 -27.45 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.05 0.453 . . . . 0.0 111.138 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.2 t -65.69 -23.7 66.83 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.36 -21.12 53.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.782 0.325 . . . . 0.0 111.536 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.8 t -76.73 87.86 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.05 0.453 . . . . 0.0 110.929 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.516 HG21 ' HG3' ' A' ' 95' ' ' ARG . 97.8 m -59.87 -48.55 81.23 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.115 -178.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.516 ' HG3' HG21 ' A' ' 94' ' ' THR . 69.2 mtm180 -134.12 148.13 50.94 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.633 0.254 . . . . 0.0 111.345 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -157.74 153.33 26.4 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.749 0.309 . . . . 0.0 111.609 177.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -169.18 151.26 4.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -73.14 126.31 29.73 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.74 174.83 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -170.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 23.4 t70 -107.91 129.16 55.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.616 -177.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.551 HD22 HD13 ' A' ' 56' ' ' LEU . 80.9 mt -96.56 152.06 18.99 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.993 0.425 . . . . 0.0 111.91 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.638 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 28.1 t70 -86.3 174.71 8.88 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.92 177.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.33 65.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -96.27 9.42 41.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.139 0.495 . . . . 0.0 111.052 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.461 ' O ' HD21 ' A' ' 101' ' ' LEU . . . 93.52 -33.98 4.86 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 121.243 -0.503 . . . . 0.0 113.658 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.8 t -54.41 122.82 40.13 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 31.2 Cg_exo -59.84 103.97 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 112.264 176.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.638 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 83.6 mm-40 -76.55 68.36 2.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.444 0.64 . . . . 0.0 111.77 -177.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' A' ' 112' ' ' HIS . 2.3 pp -100.32 5.39 44.47 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.538 176.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.93 -49.3 72.26 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.482 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.16 -19.62 62.4 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.215 0.531 . . . . 0.0 111.079 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . 0.445 ' HB3' ' O ' ' A' ' 109' ' ' LEU . 73.3 t60 -76.73 -30.1 56.48 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.349 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.409 HD22 ' CZ ' ' A' ' 5' ' ' TYR . 30.5 mt -104.03 -149.38 0.41 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.131 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.02 118.36 6.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.931 0.396 . . . . 0.0 111.997 -178.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 115' ' ' LEU . 9.8 tt -85.04 -7.71 59.01 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.19 0.519 . . . . 0.0 110.696 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.109 -179.313 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.515 ' O ' HG23 ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.624 0.249 . . . . 0.0 110.622 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 1' ' ' MET . 0.8 OUTLIER -171.05 80.04 0.08 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.435 0.694 . . . . 0.0 110.752 -178.57 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.8 mt -87.8 113.77 23.78 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -174.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.535 HD13 HD22 ' A' ' 36' ' ' LEU . 25.7 pt -98.51 141.79 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 170.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.502 ' HB3' HD11 ' A' ' 58' ' ' LEU . 92.2 m-85 -117.38 147.4 42.68 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.655 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 77.7 tttt -151.93 118.1 5.56 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 7' ' ' ILE . 3.3 mp -93.19 149.57 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-O 120.96 0.41 . . . . 0.0 111.678 -176.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.411 ' N ' HD22 ' A' ' 8' ' ' LEU . 2.3 pt? -160.27 171.44 19.16 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.99 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -79.89 145.65 32.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.86 0.362 . . . . 0.0 111.148 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.43 -29.99 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.524 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.03 -59.48 5.29 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.381 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.86 -34.31 74.4 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.823 0.344 . . . . 0.0 111.639 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -64.32 -47.73 78.3 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.912 0.387 . . . . 0.0 111.869 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.23 -40.12 86.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.464 0.65 . . . . 0.0 110.125 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.68 72.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.027 174.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.91 97.94 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 174.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.54 -35.83 78.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.294 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.17 -27.43 63.82 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.925 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -109.28 -0.78 18.98 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.011 0.434 . . . . 0.0 111.61 176.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.13 -0.53 46.46 Favored Glycine 0 CA--C 1.53 1.013 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 176.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -136.16 155.27 50.39 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.948 -0.737 . . . . 0.0 111.582 -175.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.655 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 44.1 t80 -128.95 160.8 31.54 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.072 172.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.502 ' HB3' HD12 ' A' ' 34' ' ' ILE . 67.1 mt-10 73.96 -168.39 0.11 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.599 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.21 22.44 70.88 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.304 -173.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.3 t -88.39 -177.23 5.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.896 0.478 . . . . 0.0 111.573 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.43 -42.49 32.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.1 t -56.79 -39.61 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 120.903 0.382 . . . . 0.0 111.717 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.34 -50.83 58.34 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.088 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.88 -27.26 68.08 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.79 0.329 . . . . 0.0 111.688 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.44 -56.03 4.89 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.069 0.461 . . . . 0.0 112.039 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -80.49 -29.71 37.35 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 118.25 -27.42 7.35 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.975 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -152.08 166.5 31.42 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.212 0.529 . . . . 0.0 111.597 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.502 HD12 ' HB3' ' A' ' 23' ' ' GLU . 50.4 mt -80.18 149.44 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.798 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -111.86 121.19 44.36 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.007 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.597 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 6.2 mp -119.28 -175.42 2.93 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 171.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.9 m -146.71 153.4 40.21 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.05 -166.83 1.7 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.824 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.8 -69.99 1.11 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 114.138 0.415 . . . . 0.0 114.138 -175.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.18 88.25 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.922 0.392 . . . . 0.0 111.59 -177.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -61.34 -46.24 91.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.489 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.07 -42.59 99.36 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.742 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -59.9 -48.72 80.55 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 120.989 0.424 . . . . 0.0 111.555 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -73.12 -41.29 64.16 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.4 m -59.5 -42.0 91.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.973 0.416 . . . . 0.0 111.104 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.435 ' HB2' ' HG2' ' A' ' 107' ' ' PRO . . . -58.87 -42.49 89.55 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.063 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.21 68.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -82.44 -63.22 1.42 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.07 0.462 . . . . 0.0 112.058 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -74.31 -40.13 62.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -172.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -117.02 34.45 5.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.128 0.489 . . . . 0.0 110.907 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 51' ' ' ARG . 2.9 ptm180 -36.06 -52.7 0.77 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -176.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.615 ' HA2' HD12 ' A' ' 101' ' ' LEU . . . -156.29 47.25 0.49 Allowed Glycine 0 CA--C 1.522 0.524 0 C-N-CA 120.858 -0.687 . . . . 0.0 113.495 -176.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.541 ' HB2' HD23 ' A' ' 56' ' ' LEU . 64.2 mt-30 -87.5 158.5 18.92 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.722 0.296 . . . . 0.0 110.893 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.38 128.89 34.99 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 67.56 84.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.828 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' A' ' 53' ' ' GLN . 96.1 mt -112.69 129.83 56.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.531 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.41 ' O ' HD22 ' A' ' 8' ' ' LEU . 60.3 t -102.64 130.79 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.057 0.456 . . . . 0.0 111.439 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.511 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.6 tp -99.44 104.03 15.85 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 175.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.412 HD21 HG13 ' A' ' 93' ' ' VAL . 82.7 mt -76.29 109.81 10.29 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.075 0.464 . . . . 0.0 111.376 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -101.12 115.84 31.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.41 175.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 4' ' ' ILE . 51.8 t -126.24 131.86 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.636 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.4 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 18.6 tt0 -92.22 105.28 17.53 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.17 0.509 . . . . 0.0 111.985 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.58 84.85 7.06 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.425 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.589 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 41.2 mt-10 -80.58 -44.8 1.32 Allowed Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 178.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.589 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 10.9 Cg_endo -53.9 -62.27 0.33 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.828 1.685 . . . . 0.0 112.294 177.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.563 HD11 ' HB3' ' A' ' 70' ' ' LEU . 18.6 tp 57.13 22.92 7.97 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.23 0.538 . . . . 0.0 111.985 172.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -93.77 -83.31 1.57 Allowed Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.501 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -102.34 5.56 39.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.029 0.442 . . . . 0.0 111.167 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.508 ' O ' HD13 ' A' ' 84' ' ' LEU . 4.0 p-10 -92.79 -64.17 1.13 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.182 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.563 ' HB3' HD11 ' A' ' 66' ' ' LEU . 42.0 tp -107.89 147.7 30.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.916 0.388 . . . . 0.0 111.09 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -136.63 101.04 4.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.006 0.432 . . . . 0.0 111.94 -174.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -70.28 119.82 15.03 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -158.32 144.63 17.27 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.602 -172.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 80' ' ' ARG . . . -149.51 158.1 43.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.251 0.548 . . . . 0.0 112.407 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.6 m -154.78 126.74 7.64 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.176 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 76' ' ' ARG . 3.8 mpt_? 69.83 -59.99 0.49 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 176.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.2 -15.38 44.16 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.352 0.501 . . . . 0.0 114.352 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 79.2 -45.07 2.74 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.608 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.81 134.86 57.51 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.931 0.396 . . . . 0.0 112.047 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.456 ' HA ' ' HB3' ' A' ' 74' ' ' ALA . 83.6 mtt180 -79.1 110.89 14.77 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.153 -177.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -95.17 117.64 66.69 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-O 120.756 0.313 . . . . 0.0 111.712 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -66.82 102.19 0.61 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.661 2.24 . . . . 0.0 112.374 175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -90.94 115.4 27.94 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.133 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 69' ' ' ASP . 55.2 tp -105.24 130.57 53.36 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.707 0.289 . . . . 0.0 110.543 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -110.32 37.11 2.82 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.421 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 20.5 ptp180 -167.55 138.42 2.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 O-C-N 122.452 -0.155 . . . . 0.0 110.986 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 26.8 Cg_exo -62.48 149.33 91.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 122.721 2.281 . . . . 0.0 113.046 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -108.99 118.56 37.11 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.33 0.586 . . . . 0.0 111.282 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -71.04 135.56 47.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.058 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 30.0 m -57.88 -35.24 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -172.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -72.54 -3.77 26.56 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.729 0.3 . . . . 0.0 111.722 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -98.01 -11.86 22.55 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.808 0.337 . . . . 0.0 111.77 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.412 HG13 HD21 ' A' ' 59' ' ' LEU . 57.6 t -66.61 124.81 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 O-C-N 122.319 -0.238 . . . . 0.0 111.407 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.462 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 40.8 m -59.72 -38.83 82.74 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.768 0.318 . . . . 0.0 111.645 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -160.85 143.13 12.55 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.301 0.572 . . . . 0.0 112.231 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.3 pt-20 -106.7 84.07 1.95 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.489 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.511 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -74.6 84.31 2.06 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.216 0.532 . . . . 0.0 112.209 -175.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 102.22 1.59 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.573 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 pp -116.15 168.37 10.17 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -122.87 176.12 6.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.521 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.615 HD12 ' HA2' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -158.74 179.07 9.44 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.816 -179.221 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -113.87 170.28 8.38 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.478 0.656 . . . . 0.0 112.127 170.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.75 94.02 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.366 -178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 91.25 -6.58 0.26 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.791 0.836 . . . . 0.0 109.678 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -60.19 -39.89 96.54 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.481 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 t 67.13 141.14 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 123.951 0.442 . . . . 0.0 112.153 169.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.531 ' HD3' HD13 ' A' ' 101' ' ' LEU . 53.2 Cg_exo -35.01 101.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 123.138 2.559 . . . . 0.0 113.888 -173.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -70.4 80.22 0.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.555 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.4 mp -79.39 -23.56 43.2 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.307 -0.406 . . . . 0.0 112.072 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.59 -41.5 26.17 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.635 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -78.05 -13.67 59.79 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -95.58 -13.12 24.67 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.615 0.245 . . . . 0.0 111.173 179.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 42.7 mt -110.33 162.66 14.42 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 65.94 -72.05 0.08 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 170.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 52.2 tp -87.88 152.3 22.19 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.4 0.619 . . . . 0.0 112.519 -171.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 . . . . . 0 CA--C 1.538 0.494 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.864 175.795 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.9 mmt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.219 0.533 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.452 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 53.3 p -79.14 29.38 0.22 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -177.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.7 mt -81.98 105.96 13.51 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.987 -0.446 . . . . 0.0 111.406 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CG2' ' HB3' ' A' ' 36' ' ' LEU . 13.6 mt -92.35 142.92 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.19 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -130.72 119.42 22.33 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.664 0.269 . . . . 0.0 111.609 -177.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.452 ' HZ1' ' HG ' ' A' ' 36' ' ' LEU . 33.8 ttpt -127.24 123.06 35.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.651 0.262 . . . . 0.0 111.673 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.472 HD11 ' N ' ' A' ' 7' ' ' ILE . 4.1 mp -91.69 138.14 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -178.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -149.69 174.54 12.46 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.189 175.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.9 p -82.48 151.97 26.28 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.943 -0.473 . . . . 0.0 111.063 177.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -30.06 64.37 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.832 0.348 . . . . 0.0 110.497 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.37 39.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.26 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -58.29 -43.55 88.11 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 111.144 178.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.499 ' CH2' HG12 ' A' ' 90' ' ' VAL . 28.4 t-105 -62.74 -51.74 65.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.678 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.545 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 12.4 t70 -59.44 -47.42 85.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.327 0.584 . . . . 0.0 110.784 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.41 -46.71 76.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.467 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.72 74.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.59 ' HZ3' ' HB2' ' A' ' 17' ' ' LYS . 10.4 mtmp? -65.71 -27.92 68.68 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.683 0.278 . . . . 0.0 110.958 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.27 83.68 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.135 0.493 . . . . 0.0 111.091 173.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -80.23 -26.53 39.04 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.235 0.541 . . . . 0.0 110.856 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.06 -10.77 51.87 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.447 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HG2' HD13 ' A' ' 89' ' ' LEU . 24.8 mtt-85 -135.73 121.68 19.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.59 -0.359 . . . . 0.0 110.821 -178.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -78.6 86.67 4.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 172.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.11 80.27 9.24 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.194 0.521 . . . . 0.0 112.089 -174.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.67 -135.35 48.68 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.58 -0.737 . . . . 0.0 114.565 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 28' ' ' ASP . 46.5 t 170.42 177.48 0.05 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.627 0.771 . . . . 0.0 110.25 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.41 -49.12 77.24 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 122.003 -0.436 . . . . 0.0 111.865 -179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.485 HG23 ' NE2' ' A' ' 35' ' ' HIS . 10.7 p -65.33 -24.52 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 111.597 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 25' ' ' SER . 0.3 OUTLIER -64.12 -53.66 46.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.758 175.094 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.27 -30.61 68.42 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 120.621 0.248 . . . . 0.0 111.082 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.17 77.92 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.868 0.366 . . . . 0.0 111.709 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.495 ' HB3' ' CE1' ' A' ' 33' ' ' PHE . 3.5 m-20 -87.91 -29.67 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.103 0.477 . . . . 0.0 111.566 173.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.18 -6.67 81.28 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.902 -170.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.604 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -151.45 143.81 24.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.225 0.61 . . . . 0.0 111.092 -177.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mt -60.53 130.42 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -168.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.485 ' NE2' HG23 ' A' ' 27' ' ' VAL . 33.7 m-70 -72.45 140.12 48.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.736 170.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HZ1' ' A' ' 6' ' ' LYS . 3.4 mp -145.61 -64.51 0.32 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.68 0.276 . . . . 0.0 110.714 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 56.2 m 78.71 160.29 0.19 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.81 177.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -97.72 177.58 5.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.864 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -41.86 -47.97 5.13 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 114.677 0.631 . . . . 0.0 114.677 -175.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -54.61 -69.02 0.14 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.426 0.631 . . . . 0.0 111.781 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.531 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 22.2 mp0 -68.91 -20.09 64.22 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.888 -175.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.96 -56.52 8.71 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.698 0.285 . . . . 0.0 111.358 178.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.449 ' NE2' ' HA ' ' A' ' 108' ' ' GLN . 29.3 tt0 -61.74 -39.82 92.92 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 111.728 0.269 . . . . 0.0 111.728 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -58.97 -56.4 22.75 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.979 0.419 . . . . 0.0 110.935 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -56.02 -34.02 65.44 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.122 176.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.54 -49.42 73.55 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.624 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.24 -33.07 74.69 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.054 0.454 . . . . 0.0 111.911 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -77.05 -53.03 8.31 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.36 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -88.79 -42.26 12.02 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -174.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -112.74 57.12 0.66 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.169 0.509 . . . . 0.0 110.713 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -4.54 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -172.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.88 73.63 0.02 OUTLIER Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.372 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.507 ' HB2' HD22 ' A' ' 56' ' ' LEU . 88.0 mt-30 -107.3 26.0 10.73 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 121.452 0.644 . . . . 0.0 110.996 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 64.46 -78.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.49 63.22 7.22 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.576 0.703 . . . . 0.0 111.367 -172.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.655 HD12 HD21 ' A' ' 101' ' ' LEU . 52.2 mt -88.5 138.92 31.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.606 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 59.7 t -123.51 141.92 42.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.648 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 8.8 tt -109.38 115.4 29.88 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.899 0.38 . . . . 0.0 110.615 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.1 108.59 13.82 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.87 0.366 . . . . 0.0 111.317 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.04 110.38 22.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.5 t -120.01 116.68 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.45 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.451 ' HG2' ' OG1' ' A' ' 94' ' ' THR . 11.8 pt-20 -79.41 103.38 9.29 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.594 0.711 . . . . 0.0 110.902 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.452 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.16 40.62 0.27 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.142 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -75.85 -45.89 3.98 Favored Pre-proline 0 CA--C 1.548 0.888 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -83.75 -157.23 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 122.216 1.944 . . . . 0.0 112.374 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 69' ' ' ASP . 90.5 mt 67.83 -55.38 0.49 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.366 1.066 . . . . 0.0 112.072 -177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.08 -102.94 1.3 Allowed Glycine 0 CA--C 1.528 0.906 0 CA-C-N 116.213 -0.449 . . . . 0.0 113.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -69.82 -13.92 62.5 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.485 ' HB2' ' HB3' ' A' ' 66' ' ' LEU . 58.1 m-20 -67.27 -17.62 64.87 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.5 tp -123.33 149.88 44.32 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.526 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 8.1 ttpm? -149.25 128.36 12.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.925 0.393 . . . . 0.0 111.308 171.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.463 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 53.4 m95 -72.55 86.79 1.19 Allowed 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -86.17 128.89 34.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.961 -169.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.571 ' HB3' HH11 ' A' ' 80' ' ' ARG . . . -76.58 152.01 36.09 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.482 0.658 . . . . 0.0 112.729 -176.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.0 t -130.93 -178.64 4.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.0 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -55.44 103.45 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.913 0.485 . . . . 0.0 111.682 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.25 -16.62 5.7 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.473 -0.394 . . . . 0.0 112.916 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.45 -2.64 59.18 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.324 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.51 140.35 57.99 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.704 -0.292 . . . . 0.0 111.757 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.571 HH11 ' HB3' ' A' ' 74' ' ' ALA . 24.9 mmm180 -102.66 111.91 24.44 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.734 0.302 . . . . 0.0 111.262 -177.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -107.45 114.15 61.06 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-O 120.637 0.256 . . . . 0.0 111.364 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 43.6 Cg_endo -67.37 103.09 0.75 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.35 2.034 . . . . 0.0 112.819 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.604 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 31.3 m80 -98.91 129.82 45.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.928 176.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.3 tp -95.07 137.26 34.37 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 175.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.507 ' OH ' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 m-85 -105.61 12.91 30.65 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -173.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.4 mtm180 -141.67 154.44 66.14 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 122.664 0.386 . . . . 0.0 110.695 173.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.6 132.63 52.96 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.532 2.155 . . . . 0.0 113.105 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.6 tp -79.3 105.45 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.863 0.363 . . . . 0.0 111.707 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.424 HD13 ' HG2' ' A' ' 21' ' ' ARG . 3.7 mm? -63.98 123.53 19.24 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.238 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.499 HG12 ' CH2' ' A' ' 13' ' ' TRP . 76.3 t -56.2 -39.44 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.955 0.407 . . . . 0.0 111.815 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.6 t -72.96 -4.53 32.74 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -99.56 -11.49 20.96 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 120.998 0.428 . . . . 0.0 111.378 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -69.25 135.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-O 120.933 0.397 . . . . 0.0 111.706 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.451 ' OG1' ' HG2' ' A' ' 62' ' ' GLU . 61.3 m -65.15 -50.0 67.67 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.064 0.459 . . . . 0.0 111.597 -179.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -155.31 143.09 19.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.284 0.564 . . . . 0.0 111.671 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -97.15 86.49 3.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.335 171.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.514 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -75.98 86.45 2.9 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -171.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -66.81 139.28 57.77 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.924 172.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.463 HD21 ' N ' ' A' ' 99' ' ' LEU . 2.0 pt? -141.2 145.11 35.21 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.143 0.497 . . . . 0.0 112.088 -177.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.63 131.82 34.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.395 172.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.655 HD21 HD12 ' A' ' 56' ' ' LEU . 88.4 mt -71.14 149.84 46.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.119 0.485 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.82 166.15 3.55 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.639 175.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.84 66.8 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.126 0.489 . . . . 0.0 111.7 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -83.41 -10.93 58.11 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.501 0.667 . . . . 0.0 110.078 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.94 18.89 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.695 -0.684 . . . . 0.0 113.008 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 73.4 t -103.91 123.43 41.07 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 83.04 1.04 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 170.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.449 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 2.8 pt20 -80.25 115.37 19.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.433 0.635 . . . . 0.0 112.227 -174.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -88.63 -29.92 19.59 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -47.24 -46.12 21.41 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.414 -0.422 . . . . 0.0 113.556 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -64.93 -40.29 94.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.858 0.361 . . . . 0.0 111.575 177.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -79.02 -24.17 43.86 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -174.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 46.6 mt -93.69 -101.6 0.14 Allowed 'General case' 0 CA--C 1.542 0.658 0 O-C-N 122.321 -0.237 . . . . 0.0 111.287 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 67.76 -33.53 0.22 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 176.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.1 mt 57.7 25.11 11.39 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.323 0.582 . . . . 0.0 110.81 -172.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.54 0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.154 -177.284 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -69.61 96.1 0.91 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.711 173.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 pt -92.2 147.32 5.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.751 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.532 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 43.2 m-85 -119.79 147.44 44.64 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -170.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -126.79 123.59 37.74 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.553 171.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.0 mt -96.56 130.1 45.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.731 0.3 . . . . 0.0 111.468 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -147.71 174.55 11.69 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.811 176.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.4 t -79.79 143.97 33.97 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.797 0.332 . . . . 0.0 111.301 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -55.92 -44.1 78.01 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.68 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.5 -37.72 57.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 111.927 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.56 -41.64 65.54 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.131 0.491 . . . . 0.0 110.893 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -64.45 -49.44 71.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.976 -0.557 . . . . 0.0 112.166 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -58.03 -39.53 78.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.717 0.294 . . . . 0.0 111.559 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -50.64 71.43 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.954 0.407 . . . . 0.0 111.241 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -41.7 89.3 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.163 0.506 . . . . 0.0 111.402 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.402 ' HA ' HG21 ' A' ' 90' ' ' VAL . 24.5 ttmm -63.48 -31.08 72.14 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.08 -40.73 78.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -76.41 -30.55 57.49 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.9 1.14 82.81 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.053 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -141.07 146.56 37.3 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.864 0.364 . . . . 0.0 111.966 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -128.04 99.75 5.61 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.12 0.486 . . . . 0.0 110.283 173.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.476 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 3.6 pm0 -71.83 163.89 27.0 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.068 0.461 . . . . 0.0 111.563 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.73 111.46 4.2 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.229 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -67.19 158.39 31.43 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.716 0.293 . . . . 0.0 111.645 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.09 -37.12 43.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.975 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.88 -49.04 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 111.292 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.492 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 8.2 m-20 -62.71 -46.23 89.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.57 -33.24 75.45 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.666 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.29 -37.09 86.25 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.978 0.418 . . . . 0.0 111.78 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -81.42 -51.63 8.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.146 0.498 . . . . 0.0 111.291 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 153.46 71.44 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.416 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 68.64 -176.69 0.21 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.897 0.479 . . . . 0.0 111.597 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.66 103.11 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.302 0.572 . . . . 0.0 111.618 -175.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 8.2 p80 -86.55 106.45 17.55 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.23 0.538 . . . . 0.0 112.218 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -91.55 166.31 12.9 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.1 p -142.72 140.58 31.54 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.902 -0.499 . . . . 0.0 112.163 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.03 157.58 34.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.942 176.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.62 -48.3 8.89 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 114.383 0.513 . . . . 0.0 114.383 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.02 -42.67 89.37 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.188 0.518 . . . . 0.0 111.516 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.88 -40.72 91.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.484 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.41 76.49 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.62 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.736 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 13.1 tm0? -56.58 -50.33 72.27 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -58.06 -56.79 17.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.16 0.505 . . . . 0.0 111.837 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 34.3 m -59.78 -31.24 69.5 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.026 0.441 . . . . 0.0 111.115 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 107' ' ' PRO . . . -62.68 -45.2 93.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.103 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.551 ' HA ' HG13 ' A' ' 106' ' ' VAL . . . -66.0 -33.71 76.42 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.976 0.417 . . . . 0.0 111.855 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.7 -54.05 6.24 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -106.82 -40.7 5.42 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -169.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.2 m-85 -85.64 2.5 44.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.072 0.463 . . . . 0.0 112.186 -173.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.654 ' HA ' ' HD3' ' A' ' 107' ' ' PRO . 45.0 ptt85 -57.25 141.15 47.65 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.547 175.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.48 -17.81 22.58 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.063 -0.589 . . . . 0.0 113.928 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -87.55 97.45 10.86 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.282 0.563 . . . . 0.0 111.287 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.18 54.12 0.97 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.049 0.452 . . . . 0.0 111.894 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -158.8 36.37 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.42 0.628 . . . . 0.0 110.57 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -95.66 155.42 16.75 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.503 -173.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.1 t -123.75 130.27 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.328 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.1 tp -98.4 103.93 15.92 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.639 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.532 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 79.8 mt -86.89 113.9 23.08 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.51 124.45 40.5 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.926 0.393 . . . . 0.0 111.963 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.0 t -124.65 132.01 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 122.788 0.435 . . . . 0.0 110.887 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' A' ' 64' ' ' GLU . 38.7 mt-10 -79.4 66.1 4.76 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . 34.16 -78.41 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.1 mm-40 73.18 132.72 0.04 OUTLIER Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 123.705 0.802 . . . . 0.0 111.779 -170.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 64' ' ' GLU . 12.8 Cg_exo -70.38 26.16 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.574 2.85 . . . . 0.0 114.903 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.85 59.41 4.12 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.387 0.613 . . . . 0.0 111.756 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' A' ' 70' ' ' LEU . . . -58.76 -11.49 10.99 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 115.751 -0.659 . . . . 0.0 114.062 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.81 -42.32 99.67 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.723 0.409 . . . . 0.0 111.831 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -105.61 -30.95 9.17 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.485 HD11 ' HB2' ' A' ' 82' ' ' PRO . 57.5 tp -104.7 101.8 11.41 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.954 0.407 . . . . 0.0 110.762 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -114.04 124.04 51.16 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -69.97 80.09 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.567 0.699 . . . . 0.0 109.132 171.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -100.5 137.39 38.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.236 -169.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -74.81 95.05 2.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.45 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 t -72.74 146.39 46.45 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.088 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 57.22 20.21 5.53 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.843 0.354 . . . . 0.0 111.886 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.03 42.3 99.66 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.351 -176.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.02 -99.69 0.32 Allowed Glycine 0 CA--C 1.531 1.059 0 C-N-CA 120.745 -0.741 . . . . 0.0 114.027 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -80.11 145.1 32.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -86.31 96.0 9.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.978 0.418 . . . . 0.0 111.6 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.7 129.14 39.19 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.485 ' HB2' HD11 ' A' ' 70' ' ' LEU . 33.2 Cg_endo -64.76 100.34 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.515 2.143 . . . . 0.0 112.723 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -93.38 126.88 38.75 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.471 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 tp -92.5 116.05 28.64 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.402 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -84.22 22.32 1.24 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -149.77 156.92 38.64 Favored Pre-proline 0 CA--C 1.54 0.569 0 O-C-N 122.28 -0.262 . . . . 0.0 110.552 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.24 140.91 32.7 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.879 2.386 . . . . 0.0 113.852 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -89.45 98.1 11.58 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.079 0.466 . . . . 0.0 111.061 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.55 132.58 47.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.784 0.326 . . . . 0.0 110.754 176.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.402 HG21 ' HA ' ' A' ' 17' ' ' LYS . 98.2 t -59.7 -39.23 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 120.934 0.397 . . . . 0.0 111.302 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 64.1 m -68.33 -8.96 44.45 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -88.71 -28.17 20.73 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.031 0.444 . . . . 0.0 110.967 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.3 t -66.37 143.4 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.438 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.465 HG22 ' HG3' ' A' ' 95' ' ' ARG . 93.3 m -74.05 -65.08 0.88 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.723 0.297 . . . . 0.0 111.192 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 94' ' ' THR . 37.3 mtp85 -148.15 159.55 43.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.143 0.496 . . . . 0.0 111.853 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -110.37 162.1 14.98 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.703 175.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.9 107.77 3.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.619 0.247 . . . . 0.0 111.474 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -60.2 120.1 9.14 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.011 0.434 . . . . 0.0 110.612 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 100' ' ' ASP . 2.8 tm? -111.27 132.88 54.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.196 -172.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.443 ' N ' HD13 ' A' ' 99' ' ' LEU . 4.2 t70 -124.26 -179.27 4.38 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 120.903 0.382 . . . . 0.0 111.499 -177.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.1 mt -94.66 165.76 12.35 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -173.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.569 ' HB3' ' HB2' ' A' ' 108' ' ' GLN . 5.7 p-10 -106.29 -162.99 0.89 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.109 0.481 . . . . 0.0 111.174 174.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.48 -30.59 68.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -89.72 -3.31 58.26 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.82 19.18 68.42 Favored Glycine 0 CA--C 1.525 0.685 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.956 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.551 HG13 ' HA ' ' A' ' 47' ' ' ALA . 74.2 t -99.8 137.76 20.24 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 122.862 0.465 . . . . 0.0 110.927 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.654 ' HD3' ' HA ' ' A' ' 51' ' ' ARG . 76.0 Cg_exo -51.66 101.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.152 1.901 . . . . 0.0 111.15 171.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 102' ' ' ASP . 53.9 tp60 -79.26 82.79 5.37 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -167.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.736 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 8.3 mp -83.98 -14.03 51.8 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.785 171.035 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.14 -41.5 92.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.891 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -83.21 -29.1 28.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 174.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' HIS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 109' ' ' LEU . 75.8 t60 -76.11 -21.08 57.06 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.891 0.377 . . . . 0.0 111.817 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.7 mt . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 121.151 0.5 . . . . 0.0 111.307 -179.687 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.545 ' O ' ' HA ' ' A' ' 62' ' ' GLU . 74.7 p . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.64 0.257 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.539 HD12 ' HB1' ' A' ' 60' ' ' ALA . 3.8 mm? -83.5 122.86 29.11 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.254 0.549 . . . . 0.0 112.281 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 61' ' ' VAL . 15.6 pt -108.74 143.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.72 171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.504 ' HB3' HD11 ' A' ' 58' ' ' LEU . 40.0 m-85 -120.46 144.53 47.93 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -166.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -150.29 120.13 7.1 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.232 170.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 59.7 mt -92.49 129.74 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.942 0.401 . . . . 0.0 111.928 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -119.51 161.35 20.72 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.067 0.46 . . . . 0.0 111.731 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.5 p -83.51 142.48 30.87 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 166.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -52.22 -37.79 56.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.4 -42.95 67.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.39 -54.65 7.17 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.327 0.584 . . . . 0.0 111.626 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.485 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 50.0 t-105 -68.09 -32.59 73.02 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -64.88 -43.5 92.71 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.58 0.705 . . . . 0.0 110.124 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.26 81.83 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.01 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.67 -45.24 81.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.076 174.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.4 mttm -58.31 -39.21 78.77 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.011 0.434 . . . . 0.0 110.914 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.16 -30.25 71.33 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.141 0.496 . . . . 0.0 111.614 178.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -88.67 -28.02 20.87 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.817 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.42 -4.51 85.24 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.992 -170.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.599 ' HG3' HD23 ' A' ' 89' ' ' LEU . 46.1 ttp180 -146.16 141.56 27.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.462 0.305 . . . . 0.0 111.27 -178.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -103.73 141.4 36.15 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.137 0.494 . . . . 0.0 110.546 171.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -73.78 -165.27 0.27 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.58 -83.64 1.06 Allowed Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.375 -0.917 . . . . 0.0 111.675 172.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.43 ' H ' HD23 ' A' ' 29' ' ' LEU . 30.0 t 163.96 163.31 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.473 1.109 . . . . 0.0 109.426 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.27 57.38 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.244 0.545 . . . . 0.0 110.642 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.0 t -72.72 -55.08 14.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.291 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -51.95 -46.09 64.61 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.95 0.405 . . . . 0.0 111.97 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.43 HD23 ' H ' ' A' ' 25' ' ' SER . 4.0 mm? -73.18 -25.33 60.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.28 86.15 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.147 0.498 . . . . 0.0 110.932 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.39 -39.81 74.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.293 0.568 . . . . 0.0 110.526 170.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.17 -4.51 18.27 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.681 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -165.6 163.05 19.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.824 0.345 . . . . 0.0 110.986 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -72.9 129.29 36.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.171 0.51 . . . . 0.0 111.399 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -124.14 106.71 10.55 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.121 0.486 . . . . 0.0 111.049 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.436 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 72.3 mt -86.54 175.29 8.41 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.173 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.5 p -128.58 153.63 47.03 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.985 0.421 . . . . 0.0 112.067 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.449 ' H ' ' CG ' ' A' ' 41' ' ' GLN . . . -98.36 -174.13 2.75 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.798 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -46.48 -66.12 1.87 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 114.943 0.737 . . . . 0.0 114.943 -173.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.29 -54.99 40.52 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 121.234 0.54 . . . . 0.0 111.926 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' CG ' ' H ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.99 -34.53 76.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.419 -177.21 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.98 -46.59 62.04 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.878 0.37 . . . . 0.0 111.093 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.429 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 8.3 tm0? -61.32 -41.82 97.65 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.2 -53.9 48.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 110.664 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.514 HG23 ' CD1' ' A' ' 49' ' ' TRP . 68.6 m -53.09 -38.68 62.78 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.934 0.397 . . . . 0.0 111.436 177.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.604 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -60.37 -39.01 85.69 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.58 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -82.08 -24.86 34.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.796 178.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.05 -64.79 1.11 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.149 0.5 . . . . 0.0 112.237 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.514 ' CD1' HG23 ' A' ' 45' ' ' THR . 52.9 m95 -91.65 -24.99 19.35 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.063 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.436 ' HA ' ' HG3' ' A' ' 53' ' ' GLN . 62.6 m-85 -108.1 17.6 22.13 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 40.1 ttm180 -73.09 115.6 12.61 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.81 29.67 54.12 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.135 -0.555 . . . . 0.0 114.154 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.436 ' HG3' ' HA ' ' A' ' 50' ' ' PHE . 83.5 mm-40 -88.38 -163.74 1.01 Allowed 'General case' 0 N--CA 1.473 0.716 0 O-C-N 122.446 -0.444 . . . . 0.0 111.586 177.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.32 136.08 31.19 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.526 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 55.25 81.31 0.11 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.0 mt -109.09 119.86 40.82 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.473 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 13' ' ' TRP . 21.5 t -104.99 116.61 49.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 120.831 0.348 . . . . 0.0 111.182 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 5' ' ' TYR . 63.4 tp -88.17 111.53 21.72 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.784 0.326 . . . . 0.0 111.18 178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.8 mt -83.45 119.28 24.47 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.802 0.334 . . . . 0.0 110.836 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HB1' HD12 ' A' ' 3' ' ' LEU . . . -116.02 96.25 5.49 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.108 0.48 . . . . 0.0 111.157 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 4' ' ' ILE . 36.5 t -106.08 139.27 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 2' ' ' THR . 24.5 mt-10 -89.81 127.21 35.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.974 -0.454 . . . . 0.0 110.512 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -36.37 -52.33 0.83 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 68.97 133.82 0.04 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 CA-C-O 120.868 0.366 . . . . 0.0 111.653 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.05 53.3 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 122.553 2.169 . . . . 0.0 112.888 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.09 -23.22 67.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.868 0.467 . . . . 0.0 112.201 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 139.48 -88.69 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.325 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -149.81 25.84 0.83 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 122.129 0.966 . . . . 0.0 109.928 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.56 -42.87 98.32 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.544 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 82' ' ' PRO . 17.8 tp -100.25 105.8 17.4 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.049 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -103.56 107.88 18.92 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.901 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 71.7 m95 -73.54 112.53 9.71 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.811 0.338 . . . . 0.0 111.395 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.558 ' HB2' ' CE1' ' A' ' 83' ' ' HIS . 36.5 mt-10 -139.53 134.19 31.86 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.094 0.473 . . . . 0.0 111.065 -178.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.819 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -70.32 96.53 1.14 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.035 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m -69.41 -23.87 63.77 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.856 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -118.95 28.34 8.34 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.719 0.295 . . . . 0.0 111.411 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.24 -80.75 0.72 Allowed Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.974 -0.631 . . . . 0.0 113.393 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.92 49.04 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.911 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -85.25 121.6 28.23 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.575 -0.368 . . . . 0.0 111.679 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.819 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 63.3 mtm180 -85.73 149.55 25.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.005 0.431 . . . . 0.0 111.407 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -136.28 126.01 16.03 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.402 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HB2' HD11 ' A' ' 70' ' ' LEU . 49.0 Cg_endo -68.78 111.94 2.75 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 122.4 2.067 . . . . 0.0 112.495 175.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.558 ' CE1' ' HB2' ' A' ' 73' ' ' GLU . 53.5 m170 -91.45 137.36 32.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.857 0.361 . . . . 0.0 111.789 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -117.17 118.82 33.36 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.844 0.354 . . . . 0.0 110.231 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -96.24 37.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 -164.3 155.13 13.31 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.336 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.531 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 18.2 Cg_endo -58.02 148.36 77.42 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.381 2.054 . . . . 0.0 112.92 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.81 103.39 15.95 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.101 0.476 . . . . 0.0 111.862 -172.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.599 HD23 ' HG3' ' A' ' 21' ' ' ARG . 73.8 mt -66.27 141.19 58.11 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.981 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.22 -36.21 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.274 0.559 . . . . 0.0 110.413 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.4 m -71.88 -0.23 10.79 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.938 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 4.9 tp10 -97.14 -17.43 19.92 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.202 0.525 . . . . 0.0 110.592 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HA ' HG22 ' A' ' 61' ' ' VAL . 57.3 t -78.53 121.55 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.086 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.446 HG21 ' HG3' ' A' ' 62' ' ' GLU . 12.9 m -67.68 -56.42 9.41 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.826 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -139.8 162.62 34.7 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.064 0.459 . . . . 0.0 111.705 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -150.37 158.64 44.38 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.5 177.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.47 122.37 3.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 104.91 6.66 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.91 0.386 . . . . 0.0 110.998 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.575 HD22 ' O ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -131.42 91.82 3.07 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.321 1.057 . . . . 0.0 110.883 177.435 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -91.13 90.75 7.95 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.832 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.406 HD22 ' O ' ' A' ' 105' ' ' GLY . 54.0 mt 62.65 -170.46 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 173.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -154.73 -164.98 1.94 Allowed 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.4 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.68 -29.81 28.59 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -98.85 4.13 47.46 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.133 -0.354 . . . . 0.0 111.887 -174.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.406 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 78.92 9.31 87.22 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.576 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.7 t -121.92 134.55 24.74 Favored Pre-proline 0 CA--C 1.54 0.581 0 O-C-N 122.596 -0.355 . . . . 0.0 110.809 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.604 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.8 Cg_endo -62.04 100.98 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 121.959 1.773 . . . . 0.0 112.192 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -70.27 78.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.208 0.528 . . . . 0.0 112.346 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.429 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 9.8 mp -65.45 -18.54 65.39 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 176.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.85 -36.37 41.53 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 121.265 -0.493 . . . . 0.0 113.504 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -79.85 -34.83 39.03 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.999 0.428 . . . . 0.0 111.542 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -83.3 -25.69 31.31 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -172.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 mt . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 121.436 0.636 . . . . 0.0 111.135 -179.109 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 63' ' ' ALA . 46.5 p . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 111.398 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 62' ' ' GLU . 88.0 mt -127.9 141.64 51.49 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.148 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 63' ' ' ALA . 23.0 pt -110.66 139.31 34.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.897 0.379 . . . . 0.0 111.19 177.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.416 ' HB3' HD11 ' A' ' 58' ' ' LEU . 66.0 m-85 -122.13 136.2 54.88 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.922 0.391 . . . . 0.0 111.631 -175.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.492 ' HD2' ' HG ' ' A' ' 36' ' ' LEU . 57.3 tttp -138.9 113.42 8.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.001 0.429 . . . . 0.0 111.158 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.3 mt -85.31 140.13 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.8 pt? -161.07 160.71 30.79 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.68 0.276 . . . . 0.0 110.914 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 t -70.23 151.42 45.37 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.786 0.327 . . . . 0.0 111.173 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.05 -28.35 66.37 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.786 0.327 . . . . 0.0 110.322 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.95 99.11 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.234 175.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -67.73 -46.9 70.85 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.248 0.547 . . . . 0.0 110.715 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 30.6 t-105 -60.27 -49.7 76.56 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.467 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.72 -30.72 71.78 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.46 86.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.313 0.577 . . . . 0.0 110.984 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.28 66.86 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.18 0.514 . . . . 0.0 111.371 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HA ' HG11 ' A' ' 90' ' ' VAL . 28.3 ttpp -67.3 -27.43 67.17 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.538 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -46.34 87.96 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.939 0.4 . . . . 0.0 111.272 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.437 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 24.4 pt20 -84.14 -19.86 33.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.432 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.2 -0.35 63.9 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 121.365 -0.445 . . . . 0.0 113.623 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 14.1 ptt180 -140.33 138.3 34.8 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.272 0.558 . . . . 0.0 112.141 -177.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -104.22 95.98 6.33 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.319 173.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -85.15 -1.93 57.45 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.219 0.533 . . . . 0.0 110.626 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.47 149.27 9.51 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.86 -0.609 . . . . 0.0 113.178 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.9 m -73.93 -179.56 3.79 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 122.626 -0.338 . . . . 0.0 110.294 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.91 -47.82 16.24 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -68.53 -55.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -54.74 -51.75 64.66 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.35 -36.76 83.22 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.53 -38.21 77.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.105 0.479 . . . . 0.0 111.472 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -78.49 -33.63 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.168 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.22 -5.92 84.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.241 -0.504 . . . . 0.0 112.207 -175.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 85' ' ' TYR . 31.6 m-85 -124.49 111.93 16.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.473 0.309 . . . . 0.0 110.506 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 64.8 mt -62.32 113.25 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 120.967 0.413 . . . . 0.0 111.199 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -104.21 123.87 48.1 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 112.076 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 3.8 mp -110.48 166.7 10.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.206 -179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.3 m -111.05 116.5 31.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.864 0.364 . . . . 0.0 110.799 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.72 131.35 34.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -175.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.19 -127.81 42.47 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.041 0.776 . . . . 0.0 115.041 170.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.49 -19.21 65.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.84 0.352 . . . . 0.0 111.845 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.54 -29.02 66.51 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 110.716 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.8 -44.39 81.38 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.124 0.487 . . . . 0.0 110.817 175.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.32 -41.05 96.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.077 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 31.7 tt0 -60.7 -49.94 75.49 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.696 0.284 . . . . 0.0 110.624 174.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.0 m -57.24 -35.61 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.023 0.44 . . . . 0.0 110.933 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.18 88.16 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.0 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.41 -9.96 57.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 116.31 -0.405 . . . . 0.0 112.018 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 44' ' ' GLU . 33.9 mmtp -90.17 -61.18 1.74 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.101 0.477 . . . . 0.0 111.834 177.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -110.16 -40.12 4.8 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.487 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 99.9 m-85 -96.79 16.94 17.75 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -169.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.17 141.33 41.89 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.056 0.455 . . . . 0.0 111.8 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.14 23.17 65.86 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 114.461 0.545 . . . . 0.0 114.461 175.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.487 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 74.3 mt-30 -98.85 144.61 27.86 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.429 0.615 . . . . 0.0 111.424 177.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.28 142.25 27.82 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.4 81.31 0.18 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.048 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.2 mt -114.36 151.96 32.21 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.15 0.5 . . . . 0.0 111.75 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 49.5 t -130.46 142.81 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.783 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.9 tp -111.39 104.63 13.09 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.944 0.402 . . . . 0.0 110.648 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD22 HG11 ' A' ' 93' ' ' VAL . 84.8 mt -79.9 108.38 13.43 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.913 0.387 . . . . 0.0 111.03 177.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.449 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -108.18 118.02 35.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.889 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.6 t -125.53 143.64 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.437 ' HA ' HD23 ' A' ' 3' ' ' LEU . 46.6 tt0 -72.53 125.36 27.24 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 110.839 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.547 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -82.01 37.61 0.49 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -176.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.81 117.23 39.83 Favored Pre-proline 0 CA--C 1.544 0.748 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -46.28 83.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.118 3.212 . . . . 0.0 114.596 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 66' ' ' LEU . 3.9 mp -54.03 -56.26 19.63 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.687 0.755 . . . . 0.0 109.869 171.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.24 -136.71 2.05 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.834 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 37.8 tt0 -93.51 5.87 50.14 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.297 0.57 . . . . 0.0 111.139 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -81.2 -45.76 15.85 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 tp -81.13 103.07 10.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.989 0.423 . . . . 0.0 110.912 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.654 ' HE3' ' HB2' ' A' ' 73' ' ' GLU . 35.9 ttpt -114.01 117.61 31.81 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.827 0.346 . . . . 0.0 111.912 -177.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -71.57 98.17 1.83 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.096 0.474 . . . . 0.0 109.827 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.654 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -98.53 129.88 45.1 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.23 84.15 6.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.076 0.465 . . . . 0.0 110.021 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.5 m -61.08 106.54 0.61 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -176.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 66.32 -75.51 0.05 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.46 0.704 . . . . 0.0 111.807 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.26 -159.11 33.84 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.774 177.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.84 39.76 2.43 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.344 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.434 ' HB1' ' CE2' ' A' ' 81' ' ' PHE . . . -91.08 108.22 19.72 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.56 -0.377 . . . . 0.0 111.413 -177.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -75.58 92.74 2.94 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.434 ' CE2' ' HB1' ' A' ' 79' ' ' ALA . 65.5 m-85 -117.51 109.45 41.91 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 120.912 0.387 . . . . 0.0 111.91 177.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.628 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 55.2 Cg_endo -68.9 122.43 9.34 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.695 2.263 . . . . 0.0 112.515 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -115.19 120.35 39.44 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.41 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.459 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 16.2 mt -88.62 120.15 29.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.059 0.457 . . . . 0.0 111.7 176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.434 ' HA ' ' HD1' ' A' ' 33' ' ' PHE . 4.4 m-85 -82.86 13.36 3.95 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.351 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -133.54 145.66 57.26 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.212 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -62.91 134.14 45.03 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.356 2.037 . . . . 0.0 111.845 171.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.3 tp -93.42 107.53 19.35 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.4 135.21 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.217 -0.302 . . . . 0.0 110.482 174.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 17' ' ' LYS . 18.9 m -60.53 -30.36 46.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.96 0.409 . . . . 0.0 111.874 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -63.94 -18.02 63.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.598 176.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -90.57 -19.84 23.29 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.634 -177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.463 HG11 HD22 ' A' ' 59' ' ' LEU . 58.9 t -61.99 115.73 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 120.647 0.261 . . . . 0.0 110.998 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.449 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 27.9 m -53.36 -45.38 69.14 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 95' ' ' ARG . 36.8 ttt180 -162.39 146.76 12.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.178 0.513 . . . . 0.0 112.021 174.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -101.78 95.47 6.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.535 0.683 . . . . 0.0 110.199 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -77.91 137.74 38.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.761 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -75.66 149.11 38.23 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.471 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 107' ' ' PRO . 29.5 tp -140.07 133.24 29.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -123.77 171.12 9.87 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.296 0.57 . . . . 0.0 111.861 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.72 149.55 27.19 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.742 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -96.64 -161.4 0.87 Allowed 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.099 0.476 . . . . 0.0 111.41 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.15 -23.57 67.16 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -94.04 -9.99 34.95 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.139 -0.351 . . . . 0.0 111.544 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.01 22.01 60.12 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.242 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.1 t -100.5 130.27 26.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 O-C-N 122.722 -0.281 . . . . 0.0 111.134 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.688 ' HB3' HD21 ' A' ' 99' ' ' LEU . 45.8 Cg_exo -57.72 104.94 0.18 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.369 2.046 . . . . 0.0 112.212 174.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -75.51 100.18 4.45 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.4 mp -100.09 -19.91 16.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.074 176.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.4 -44.85 28.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.245 -176.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -72.0 -30.48 65.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -34.48 72.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 178.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 25.1 mt . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 121.171 0.51 . . . . 0.0 111.934 -175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 80.7 mt -122.23 134.53 54.7 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.929 -174.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.496 HD12 HD13 ' A' ' 36' ' ' LEU . 18.5 pt -121.63 142.44 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 121.02 0.438 . . . . 0.0 111.217 176.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 78.9 m-85 -124.68 145.72 49.52 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.151 0.501 . . . . 0.0 112.263 -175.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 58.6 tttm -135.27 126.94 29.03 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.052 171.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 64.4 mt -93.67 135.62 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.651 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.534 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 pt? -156.47 173.46 16.87 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.627 0.251 . . . . 0.0 110.948 177.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.6 p -77.62 150.74 34.61 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.709 0.29 . . . . 0.0 110.702 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -56.37 -39.36 72.79 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.133 0.492 . . . . 0.0 111.081 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.3 95.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.073 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.59 -44.37 96.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.147 0.498 . . . . 0.0 110.839 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.444 ' CH2' HG13 ' A' ' 90' ' ' VAL . 26.5 t-105 -63.78 -63.81 1.06 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.248 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -29.44 67.65 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.19 -47.51 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.145 0.497 . . . . 0.0 111.095 174.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.9 -30.29 65.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.4 ttmt -56.11 -50.87 69.85 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.321 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.01 80.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.202 0.525 . . . . 0.0 111.358 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -72.44 -24.53 61.22 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.77 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.63 -11.59 13.34 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.261 -177.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -124.86 144.3 50.38 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.508 -0.407 . . . . 0.0 111.965 -176.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.684 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 63.3 t80 -149.19 111.18 4.6 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.067 0.46 . . . . 0.0 111.205 173.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.84 -4.0 44.5 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 122.181 -0.324 . . . . 0.0 111.84 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.63 -176.99 16.91 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.98 -0.628 . . . . 0.0 113.111 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.406 ' O ' HD23 ' A' ' 29' ' ' LEU . 91.4 p -100.3 178.9 4.63 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.759 -0.26 . . . . 0.0 110.356 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.8 -27.79 19.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.137 0.494 . . . . 0.0 111.156 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -68.59 -52.93 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.094 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -58.79 -40.46 84.1 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 25' ' ' SER . 4.5 mm? -65.89 -26.71 67.75 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.476 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.31 -47.07 52.69 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.804 0.335 . . . . 0.0 111.218 175.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -64.74 -34.27 77.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.178 0.514 . . . . 0.0 111.406 174.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 93.57 10.67 58.95 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.077 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -164.18 147.99 9.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.0 mt -64.74 109.09 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.064 0.459 . . . . 0.0 110.482 176.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -74.97 87.67 2.33 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.343 0.592 . . . . 0.0 111.802 -177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.496 HD13 HD12 ' A' ' 4' ' ' ILE . 80.5 mt -84.52 173.46 10.81 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.345 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.459 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 69.0 m -148.69 144.63 27.25 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.947 0.403 . . . . 0.0 111.238 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.5 163.13 28.12 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.342 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -45.55 -47.89 12.32 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.385 -0.436 . . . . 0.0 113.799 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.15 -51.79 55.78 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 5.0 mt-30 -74.67 -32.44 62.22 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.981 0.419 . . . . 0.0 111.358 -175.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.45 -49.56 74.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.16 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.495 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.2 tt0 -67.3 -41.07 85.98 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.377 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.19 -51.91 67.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.965 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -56.37 -38.83 71.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.315 0.579 . . . . 0.0 110.779 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -67.68 -27.68 67.05 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.688 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.34 -41.12 18.59 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -78.53 -42.26 29.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -105.52 -58.18 1.93 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -171.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.519 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 95.5 m-85 -91.11 12.69 19.14 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.51 119.73 12.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.045 0.45 . . . . 0.0 112.19 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.68 -0.49 65.18 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.756 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.506 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 65.7 mt-30 -92.97 116.06 28.7 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 117.158 0.479 . . . . 0.0 111.194 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.34 39.79 1.11 Allowed 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -132.36 17.54 4.45 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.744 0.307 . . . . 0.0 111.195 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.426 ' CD1' ' HB3' ' A' ' 50' ' ' PHE . 14.1 mt -94.54 124.54 38.64 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -171.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.422 ' O ' HD23 ' A' ' 8' ' ' LEU . 95.6 t -98.85 130.1 48.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.084 169.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.466 HD22 HD21 ' A' ' 99' ' ' LEU . 54.3 tp -97.87 109.37 22.14 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 110.672 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.9 mt -81.02 104.65 11.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.831 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -94.55 93.81 7.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.155 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.748 HG22 HG13 ' A' ' 93' ' ' VAL . 22.3 t -112.26 138.18 42.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.966 -176.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 39.3 mt-10 -83.77 156.11 22.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.778 0.323 . . . . 0.0 110.304 173.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.38 59.8 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.914 0.388 . . . . 0.0 111.222 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 3.8 mm-40 -64.79 -51.42 57.77 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.975 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 89.3 Cg_exo -49.86 -56.13 3.43 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.613 2.209 . . . . 0.0 113.97 177.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.648 HD22 HD11 ' A' ' 84' ' ' LEU . 3.2 pp -81.84 -1.12 46.45 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -175.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.23 -155.5 47.55 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.055 -0.593 . . . . 0.0 113.827 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -94.27 14.11 21.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.9 -17.08 64.73 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.062 0.458 . . . . 0.0 111.033 175.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.8 tp -72.46 125.43 27.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.797 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -102.51 121.43 42.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.737 0.303 . . . . 0.0 111.385 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -89.04 131.42 35.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -137.3 103.28 5.05 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.166 0.508 . . . . 0.0 111.845 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -82.47 79.34 8.94 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.053 0.454 . . . . 0.0 110.936 175.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.4 m -68.01 -21.07 65.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.031 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.6 143.52 50.97 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.659 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -51.74 105.14 0.2 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.497 -0.383 . . . . 0.0 113.558 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.83 -30.9 9.37 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.348 -0.454 . . . . 0.0 113.423 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -91.05 99.11 12.2 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.209 0.528 . . . . 0.0 111.674 -177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.499 ' HG2' ' HB2' ' A' ' 74' ' ' ALA . 20.2 mtm180 -91.01 101.26 14.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.532 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -90.86 114.81 62.67 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -173.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.84 131.33 12.13 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.528 2.152 . . . . 0.0 112.432 174.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -127.23 129.12 47.17 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.648 HD11 HD22 ' A' ' 66' ' ' LEU . 7.1 mt -106.09 111.57 24.25 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.412 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -83.53 10.78 8.21 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.725 0.298 . . . . 0.0 111.637 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 86' ' ' ARG . 10.6 ptm180 -137.77 147.61 57.62 Favored Pre-proline 0 N--CA 1.472 0.638 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -176.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.72 135.16 65.3 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.883 2.389 . . . . 0.0 113.519 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.0 tp -94.39 131.75 39.73 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -89.56 136.15 33.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.759 0.314 . . . . 0.0 110.817 177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.537 HG21 ' HA ' ' A' ' 17' ' ' LYS . 95.2 t -57.4 -34.37 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 121.263 0.554 . . . . 0.0 110.83 176.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 59.1 p -67.72 -13.49 62.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.945 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -90.4 -21.42 21.96 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 120.901 0.381 . . . . 0.0 111.396 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.748 HG13 HG22 ' A' ' 61' ' ' VAL . 85.4 t -64.79 145.31 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 72.1 m -85.47 -68.68 0.71 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 74.3 ttt180 -126.17 146.75 49.83 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -110.28 124.78 52.26 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.048 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -139.96 108.19 5.79 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.02 128.96 38.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.818 0.342 . . . . 0.0 110.26 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.466 HD21 HD22 ' A' ' 58' ' ' LEU . 86.8 mt -78.19 90.63 4.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -174.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -78.49 99.94 6.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.156 0.503 . . . . 0.0 110.493 170.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.74 150.82 28.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.189 0.519 . . . . 0.0 111.928 -178.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -138.38 171.22 14.7 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.906 -170.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.56 -83.5 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 177.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -90.65 -11.75 38.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.042 0.448 . . . . 0.0 111.267 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.15 26.68 33.16 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.478 -175.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.73 126.21 36.2 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 122.356 0.262 . . . . 0.0 110.908 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.16 140.56 49.66 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.406 2.071 . . . . 0.0 112.853 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -84.11 87.77 7.16 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.347 0.594 . . . . 0.0 112.208 -175.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 43' ' ' GLN . 11.1 mp -93.96 -4.53 49.57 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.973 -0.454 . . . . 0.0 112.163 176.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.45 74.8 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.611 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 -28.93 61.36 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.324 0.583 . . . . 0.0 111.166 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -72.71 -46.08 55.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.132 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.9 mt . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -172.69 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.12 119.3 31.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.679 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HB ' HD13 ' A' ' 36' ' ' LEU . 26.6 pt -93.69 146.45 6.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 110.85 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.525 ' HB3' HD11 ' A' ' 58' ' ' LEU . 89.0 m-85 -126.14 133.67 51.54 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.121 0.486 . . . . 0.0 112.192 -174.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE3' ' CZ ' ' A' ' 22' ' ' PHE . 47.0 tttm -130.5 117.27 19.37 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.907 174.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pp -84.3 139.37 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.901 0.381 . . . . 0.0 111.21 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.504 ' HB3' ' HZ2' ' A' ' 6' ' ' LYS . 2.2 pt? -165.96 156.47 12.93 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.933 0.397 . . . . 0.0 111.682 177.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.9 m -69.83 140.1 53.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.613 175.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -49.98 -38.34 36.51 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.24 -46.32 62.29 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 176.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.9 -43.87 82.27 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.799 0.333 . . . . 0.0 111.177 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.531 ' CH2' HG23 ' A' ' 90' ' ' VAL . 28.1 t-105 -63.08 -53.14 58.33 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -28.5 69.72 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 122.394 -0.191 . . . . 0.0 111.485 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.68 -52.27 63.95 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.071 0.462 . . . . 0.0 110.777 173.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.97 78.79 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.141 0.496 . . . . 0.0 111.14 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -66.33 -38.03 86.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.11 84.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.172 0.51 . . . . 0.0 110.831 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -71.41 -27.95 63.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.428 0.633 . . . . 0.0 110.613 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.15 4.58 89.79 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.938 -173.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 89' ' ' LEU . 36.1 ttt180 -154.47 139.29 17.14 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -173.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.52 ' CZ ' ' HE3' ' A' ' 6' ' ' LYS . 83.8 t80 -122.44 140.31 52.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -154.85 74.34 0.92 Allowed 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.695 0.759 . . . . 0.0 111.763 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.26 117.17 1.14 Allowed Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.844 -0.616 . . . . 0.0 113.458 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.442 ' N ' ' HB2' ' A' ' 28' ' ' ASP . 70.1 m -70.43 -179.94 2.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 122.638 -0.331 . . . . 0.0 110.842 175.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -46.22 -49.9 16.54 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.211 0.529 . . . . 0.0 111.794 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.8 t -70.68 -51.74 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HB2' ' N ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -54.83 -53.17 58.77 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.839 0.456 . . . . 0.0 112.193 -178.144 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 45.8 tp -62.48 -36.64 83.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.949 0.404 . . . . 0.0 111.125 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -18.29 61.03 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.906 0.384 . . . . 0.0 111.888 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.03 -47.2 7.99 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.878 0.371 . . . . 0.0 111.573 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 150.0 -40.74 0.84 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.217 -0.516 . . . . 0.0 112.825 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -150.56 178.49 9.02 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.706 0.289 . . . . 0.0 111.199 -177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -85.83 125.04 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-O 121.011 0.434 . . . . 0.0 111.549 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -107.65 90.88 3.43 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.375 0.607 . . . . 0.0 111.334 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.625 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 80.9 mt -79.55 170.78 16.06 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.194 0.521 . . . . 0.0 111.805 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -132.23 119.37 20.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.63 101.81 8.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.68 -91.85 0.01 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.489 0.556 . . . . 0.0 114.489 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -45.95 -54.95 7.45 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.025 0.53 . . . . 0.0 111.699 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -63.73 -25.03 68.01 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.732 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.18 -54.6 9.19 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.635 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.418 ' NE2' ' HB2' ' A' ' 109' ' ' LEU . 9.6 tt0 -67.92 -30.81 70.22 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.684 0.278 . . . . 0.0 111.672 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.25 -46.46 77.04 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.627 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.1 m -60.38 -38.58 84.36 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.063 0.459 . . . . 0.0 110.837 175.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.316 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -77.23 -25.67 51.86 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.928 0.394 . . . . 0.0 111.567 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -82.42 -70.62 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.164 0.507 . . . . 0.0 112.237 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -88.02 -32.64 18.7 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.521 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 88.0 m-85 -101.13 14.36 32.22 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 2.4 tmt_? -58.39 101.91 0.1 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.356 0.598 . . . . 0.0 111.429 -177.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.69 21.72 30.55 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.294 176.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.521 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 76.5 mt-30 -90.94 -179.28 5.44 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.425 0.613 . . . . 0.0 111.438 173.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.5 160.03 35.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -176.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 61.98 31.07 18.14 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.287 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.3 mt -76.85 98.32 4.83 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.453 0.644 . . . . 0.0 111.207 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.462 ' O ' HD23 ' A' ' 8' ' ' LEU . 61.0 t -83.7 125.78 40.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.804 176.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 55.2 tp -94.01 101.62 13.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 174.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 91.5 mt -75.17 109.64 8.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.695 0.283 . . . . 0.0 111.194 178.171 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.27 114.45 28.74 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.563 176.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 93' ' ' VAL . 43.4 t -126.71 127.99 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.53 90.98 2.25 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.519 0.676 . . . . 0.0 111.16 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.69 42.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.307 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 65.7 158.89 0.13 Allowed Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.579 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.9 76.55 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.902 2.401 . . . . 0.0 112.918 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.4 mt -66.98 -65.23 0.71 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.72 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 145.46 -90.65 0.15 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 120.544 -0.836 . . . . 0.0 114.017 177.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -85.02 -42.57 14.74 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -173.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.456 ' HB2' ' HG2' ' A' ' 86' ' ' ARG . 24.7 p-10 -75.45 -41.97 54.43 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 111.805 -173.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.5 tp -85.96 96.49 9.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.219 0.533 . . . . 0.0 109.83 170.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 25.5 tptp -107.54 101.97 11.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.492 -171.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -78.27 103.3 8.12 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HG3' ' HG3' ' A' ' 71' ' ' LYS . 45.3 mt-10 -119.56 107.33 13.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.939 0.4 . . . . 0.0 111.707 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.632 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -77.16 133.57 38.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.345 175.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.1 m -69.3 173.21 5.97 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -51.39 90.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.543 0.687 . . . . 0.0 112.727 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 15.04 60.74 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.767 0.667 . . . . 0.0 114.767 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 165.66 167.74 26.75 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 119.795 -1.193 . . . . 0.0 114.958 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 61.36 97.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.907 0.883 . . . . 0.0 113.332 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 8.7 ptp180 -86.92 103.13 15.01 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.237 0.542 . . . . 0.0 111.199 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -90.28 120.6 69.1 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.002 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.625 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 20.3 Cg_exo -66.31 96.99 0.35 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.677 2.251 . . . . 0.0 111.959 173.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -90.53 112.9 24.75 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.952 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.444 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 56.8 tp -104.95 123.36 47.63 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.254 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -105.36 30.8 5.37 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.54 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' HB2' ' A' ' 69' ' ' ASP . 16.7 mmt85 -132.17 148.68 70.74 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 122.35 0.26 . . . . 0.0 111.554 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.85 123.25 7.82 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.562 2.175 . . . . 0.0 112.283 174.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 tp -90.55 108.53 19.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.008 0.432 . . . . 0.0 111.537 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 21' ' ' ARG . 4.1 mm? -69.26 142.34 54.17 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.74 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.531 HG23 ' CH2' ' A' ' 13' ' ' TRP . 4.4 p -57.08 -30.98 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.438 0.637 . . . . 0.0 110.942 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.2 t -62.92 -28.08 69.81 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.286 178.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 10.0 mm-40 -87.13 -2.81 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.434 ' HA ' HG22 ' A' ' 61' ' ' VAL . 92.5 t -77.82 128.15 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 120.813 0.34 . . . . 0.0 111.412 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 28.7 m -70.5 -61.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.812 0.339 . . . . 0.0 111.377 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.412 ' HD2' HH11 ' A' ' 95' ' ' ARG . 24.0 ttt85 -148.5 145.76 28.06 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.28 0.562 . . . . 0.0 111.924 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -111.2 105.58 14.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.874 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -87.67 90.25 8.3 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.941 -0.474 . . . . 0.0 111.837 -178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -71.92 110.09 6.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.896 0.379 . . . . 0.0 111.004 177.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.9 mt -130.64 106.05 8.23 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -72.1 139.87 48.6 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 166.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 105' ' ' GLY . 83.7 mt -78.96 160.29 27.3 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -152.51 165.74 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 63.42 -84.95 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.484 0.713 . . . . 0.0 112.028 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -106.07 -22.63 12.83 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.873 0.844 . . . . 0.0 109.619 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.559 ' O ' HD13 ' A' ' 101' ' ' LEU . . . 120.25 15.05 5.22 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.296 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.551 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 39.8 t -137.32 75.13 46.69 Favored Pre-proline 0 CA--C 1.547 0.862 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.411 ' HD2' HD22 ' A' ' 101' ' ' LEU . 2.9 Cg_endo -83.56 -73.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.482 2.121 . . . . 0.0 109.413 160.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.551 ' NE2' ' HA ' ' A' ' 106' ' ' VAL . 75.3 mt-30 56.07 -147.05 0.54 Allowed 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 161.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 109' ' ' LEU . 6.3 mp -64.78 5.65 0.3 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.97 -24.32 13.86 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.645 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -98.69 -28.61 13.45 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 120.993 0.425 . . . . 0.0 111.304 175.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -69.85 -36.77 75.81 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 109' ' ' LEU . 52.8 mt . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 120.894 0.378 . . . . 0.0 111.719 -175.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.662 0.268 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.45 116.28 22.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.003 0.43 . . . . 0.0 111.526 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 17.4 pt -105.77 129.23 59.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.196 0.522 . . . . 0.0 110.55 173.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.529 ' HB3' HD11 ' A' ' 58' ' ' LEU . 6.6 m-85 -110.75 159.22 17.83 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -168.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.525 ' HZ2' ' HG ' ' A' ' 36' ' ' LEU . 6.8 ttpm? -162.11 136.65 6.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.089 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -96.67 141.2 15.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.166 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -153.64 162.66 41.05 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.649 0.261 . . . . 0.0 110.812 174.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -73.69 149.34 41.97 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 19.5 mmm-85 -53.65 -40.44 65.86 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.319 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -23.9 59.95 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 111.831 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -89.32 -48.2 7.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 110.526 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 26.3 t-105 -65.17 -55.59 17.71 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.076 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -33.82 68.57 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.31 98.79 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.053 0.454 . . . . 0.0 110.617 173.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.66 93.85 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.414 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HA ' HG21 ' A' ' 90' ' ' VAL . 52.6 mtmt -63.66 -38.3 90.61 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.514 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.26 -40.99 78.8 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.158 0.504 . . . . 0.0 111.139 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -95.89 1.01 52.73 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.826 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.53 5.03 41.85 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 114.22 0.448 . . . . 0.0 114.22 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HG2' ' CD2' ' A' ' 89' ' ' LEU . 60.4 mtt85 -138.22 130.92 29.48 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.899 -0.765 . . . . 0.0 112.255 -175.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -95.25 111.38 23.24 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -102.81 -10.96 18.66 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -172.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.08 167.82 42.01 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.15 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.2 p -90.39 172.22 8.9 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 122.335 -0.509 . . . . 0.0 111.464 -177.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.37 -32.77 62.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.286 176.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.7 t -63.09 -45.06 99.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.069 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.502 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 7.7 m-20 -56.29 -51.45 68.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.906 0.384 . . . . 0.0 111.125 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.84 -35.48 80.1 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.997 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -35.36 72.2 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.136 0.494 . . . . 0.0 112.067 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.501 ' HB3' ' CE1' ' A' ' 35' ' ' HIS . 12.2 t70 -84.24 -55.65 4.07 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.397 -178.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.34 60.35 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 121.223 -0.513 . . . . 0.0 112.696 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 80.3 m-85 64.39 -171.91 0.18 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.522 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 65.8 mt -55.55 125.46 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -173.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.502 ' CE1' ' HA ' ' A' ' 28' ' ' ASP . 0.7 OUTLIER -87.68 146.59 25.63 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.823 178.919 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 5.1 mp -142.17 175.67 9.57 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.511 0.325 . . . . 0.0 110.156 167.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.5 m -140.52 159.55 41.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.043 0.449 . . . . 0.0 112.167 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.58 -174.35 3.81 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.531 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -51.36 -72.89 0.44 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.503 -0.379 . . . . 0.0 113.994 -177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -65.78 -32.45 73.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.027 0.442 . . . . 0.0 110.974 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -63.74 -29.51 70.71 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.03 -44.21 93.22 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.063 0.458 . . . . 0.0 110.917 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -66.71 -34.76 78.55 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.92 -52.08 66.58 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.101 0.477 . . . . 0.0 110.492 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 29.4 m -57.77 -38.96 76.36 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.017 0.437 . . . . 0.0 110.938 176.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.51 -50.07 68.83 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.882 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.04 -22.25 66.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -99.94 -43.23 6.46 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -109.78 -19.51 13.12 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -170.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.526 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 92.7 m-85 -131.81 28.48 4.54 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 122.021 -0.425 . . . . 0.0 112.041 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -71.62 119.12 15.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.849 0.357 . . . . 0.0 111.882 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.5 61.09 4.32 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-N 116.199 -0.455 . . . . 0.0 113.703 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.559 ' HB2' HD11 ' A' ' 56' ' ' LEU . 49.8 mt-30 -140.98 159.95 41.11 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 111.662 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.43 175.2 5.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.341 177.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 47.3 m-80 61.26 30.23 19.08 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.166 0.508 . . . . 0.0 111.172 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 53' ' ' GLN . 84.9 mt -92.96 127.23 38.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.39 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.51 122.54 60.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.815 0.34 . . . . 0.0 111.109 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 99' ' ' LEU . 43.7 tp -88.1 98.09 11.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.849 0.357 . . . . 0.0 110.253 174.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 93.9 mt -74.18 107.27 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.823 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.49 100.74 10.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.639 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 95.9 t -109.08 131.62 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.038 0.447 . . . . 0.0 112.155 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -73.55 123.18 23.46 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.779 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.17 -52.2 64.78 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.544 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 1.8 mp0 -59.98 -48.75 93.92 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.544 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 38.1 Cg_exo -62.95 -16.11 52.01 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.153 1.902 . . . . 0.0 113.716 176.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tt -64.79 -65.83 0.62 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.0 -137.04 5.97 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.659 -0.781 . . . . 0.0 114.058 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -103.68 -21.63 13.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -172.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -78.86 30.49 0.2 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -169.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 82' ' ' PRO . 58.6 tp -112.02 140.41 46.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.024 0.44 . . . . 0.0 111.748 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -150.86 128.12 11.27 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.358 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.577 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 76.6 m95 -76.98 86.05 3.5 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.416 0.626 . . . . 0.0 110.504 175.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.2 119.42 33.68 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.468 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.98 64.43 2.46 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.228 0.537 . . . . 0.0 110.89 176.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.9 p -77.74 74.15 4.3 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.07 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.46 HH11 ' HB2' ' A' ' 76' ' ' ARG . 3.1 mtm105 67.32 161.23 0.17 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.31 -63.36 3.97 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.19 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.63 150.09 5.2 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.193 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 68.06 -169.75 0.19 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.857 0.463 . . . . 0.0 111.791 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.577 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 4.4 mpt_? -104.86 122.67 46.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.241 0.543 . . . . 0.0 112.157 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -99.72 110.51 59.16 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.027 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.553 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 51.9 Cg_exo -55.89 111.43 0.77 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.668 2.245 . . . . 0.0 113.17 175.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -97.03 132.46 42.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.031 174.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.522 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 59.1 tp -107.91 111.7 23.94 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.937 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.14 30.04 0.28 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -173.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -160.35 154.13 19.19 Favored Pre-proline 0 N--CA 1.471 0.579 0 O-C-N 122.164 -0.335 . . . . 0.0 111.418 177.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.91 118.39 5.26 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.498 2.132 . . . . 0.0 112.331 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.6 tp -72.72 100.61 2.88 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.102 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.441 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 55.1 mt -58.9 130.06 45.16 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.506 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.543 HG21 ' HA ' ' A' ' 17' ' ' LYS . 96.0 t -56.54 -34.42 41.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 110.876 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.8 p -62.51 -26.75 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.88 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -87.11 -18.49 30.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -64.11 116.24 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.981 0.42 . . . . 0.0 111.254 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.639 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 51.0 p -70.99 -46.5 62.17 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -144.67 145.02 31.54 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -135.39 136.59 41.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.079 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.29 119.63 10.24 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.45 139.14 53.96 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.896 0.379 . . . . 0.0 110.808 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.677 HD21 ' HB2' ' A' ' 58' ' ' LEU . 3.5 mm? -89.02 105.9 18.08 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.54 90.64 6.79 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 168.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.729 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 70.9 mt -89.37 156.52 18.65 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -171.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -144.2 166.25 25.58 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.724 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 54.75 -86.41 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.498 0.719 . . . . 0.0 112.9 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -97.29 -7.36 32.28 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.441 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.729 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 69.63 43.73 66.74 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.609 -175.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.869 ' H ' ' HD2' ' A' ' 107' ' ' PRO . 71.4 t -156.08 -57.85 0.02 OUTLIER Pre-proline 0 N--CA 1.485 1.323 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.869 ' HD2' ' H ' ' A' ' 106' ' ' VAL . 7.4 Cg_endo -40.69 -74.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 124.462 3.442 . . . . 0.0 116.074 -164.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.412 ' H ' ' CD ' ' A' ' 108' ' ' GLN . 0.7 OUTLIER -48.69 71.5 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -172.084 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 107' ' ' PRO . 1.3 tp -102.06 -31.06 10.81 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.777 -0.577 . . . . 0.0 111.842 170.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.21 -47.1 34.42 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.05 -26.76 68.99 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.837 0.351 . . . . 0.0 111.658 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.25 -28.59 31.76 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.907 0.384 . . . . 0.0 110.965 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 41.0 mt . . . . . 0 CA--C 1.535 0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.7 p . . . . . 0 N--CA 1.469 0.494 0 CA-C-O 120.829 0.347 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.497 HD21 ' HB1' ' A' ' 60' ' ' ALA . 2.3 tt -118.11 124.57 48.36 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 -173.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.403 HD12 HD22 ' A' ' 36' ' ' LEU . 28.9 pt -96.58 148.33 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.008 0.433 . . . . 0.0 111.219 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.482 ' HB3' HD11 ' A' ' 58' ' ' LEU . 88.2 m-85 -126.79 103.15 7.37 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -172.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 59' ' ' LEU . 23.2 tptp -89.97 109.5 20.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.832 0.348 . . . . 0.0 111.208 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.1 mt -88.86 137.01 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.214 175.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.506 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 1.7 pt? -166.11 171.13 12.71 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.992 0.425 . . . . 0.0 112.144 -177.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -80.95 148.12 29.96 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.74 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -58.13 -37.08 73.91 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.6 -21.94 65.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.758 0.313 . . . . 0.0 111.736 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HG2' ' HE1' ' A' ' 22' ' ' PHE . 41.6 tt0 -79.24 -51.71 9.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.532 0.682 . . . . 0.0 109.966 175.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.447 ' HB2' HD11 ' A' ' 8' ' ' LEU . 8.1 t-105 -64.01 -61.58 2.18 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.154 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.488 ' HA ' ' HB3' ' A' ' 17' ' ' LYS . 7.0 m-20 -60.69 -26.35 67.06 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.2 -44.45 83.87 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.127 0.489 . . . . 0.0 110.455 172.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.81 63.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.023 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.591 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.1 ttmt -66.02 -42.88 89.05 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.405 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.94 95.18 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.233 0.539 . . . . 0.0 110.753 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -65.91 -28.46 68.95 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.387 173.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.46 9.58 81.83 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.088 -171.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -150.93 112.25 4.38 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 122.609 -0.348 . . . . 0.0 111.673 -173.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.495 ' HB3' ' HB3' ' A' ' 88' ' ' LEU . 69.4 t80 -89.8 109.2 20.21 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.992 0.425 . . . . 0.0 110.688 175.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -93.97 -7.84 41.75 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.123 0.487 . . . . 0.0 111.129 -178.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.88 -177.7 19.39 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.922 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -104.63 -174.79 2.62 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 122.722 -0.281 . . . . 0.0 110.456 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.38 -43.79 61.99 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.98 0.419 . . . . 0.0 111.876 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.6 -40.85 82.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.865 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.61 -46.0 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.022 0.439 . . . . 0.0 110.919 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.51 -34.03 77.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.277 175.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.99 -44.02 97.61 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 111.027 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -69.48 -32.54 71.5 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.952 0.406 . . . . 0.0 111.136 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.31 -11.51 51.27 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.462 -0.399 . . . . 0.0 112.626 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -153.08 155.09 36.16 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.672 0.389 . . . . 0.0 110.731 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.0 mt -73.23 141.75 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.485 0.659 . . . . 0.0 112.233 -172.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -133.34 100.06 4.72 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.677 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 36' ' ' LEU . 4.8 mp -82.14 -32.74 29.93 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -171.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.2 m 73.22 165.14 0.29 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.885 0.474 . . . . 0.0 111.178 -174.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.37 131.26 20.32 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.08 -104.46 0.07 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 115.184 0.834 . . . . 0.0 115.184 171.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -48.59 -45.32 37.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.192 0.597 . . . . 0.0 111.67 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -68.33 -38.52 81.6 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.54 65.8 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.672 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.0 -39.19 94.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.87 -52.29 57.35 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.22 0.533 . . . . 0.0 110.593 177.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 m -58.68 -33.02 69.67 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.176 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.21 -48.55 81.0 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.778 0.323 . . . . 0.0 111.108 175.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -39.67 93.01 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.882 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -71.96 -43.79 64.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.994 0.426 . . . . 0.0 111.95 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -109.42 -66.05 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -172.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -76.23 -8.1 56.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -163.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -63.31 2.16 0.42 Allowed 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -173.412 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -149.07 40.05 0.91 Allowed Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -122.67 174.9 6.81 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.18 0.514 . . . . 0.0 111.67 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.26 161.49 17.14 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.276 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 59.8 36.8 22.12 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.206 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.402 HD12 HD21 ' A' ' 101' ' ' LEU . 89.2 mt -74.56 128.66 36.11 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.166 0.508 . . . . 0.0 111.904 -177.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.2 t -121.86 145.83 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.892 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 5' ' ' TYR . 47.2 tp -114.95 102.25 9.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.15 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 6' ' ' LYS . 90.4 mt -84.68 117.46 23.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.856 0.36 . . . . 0.0 111.414 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HB1' HD21 ' A' ' 3' ' ' LEU . . . -102.88 115.83 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.116 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 50.2 t -126.08 137.32 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 111.657 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -77.83 130.99 37.35 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.753 0.311 . . . . 0.0 110.62 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.61 -28.37 28.53 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.584 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 7.0 mp0 -63.82 -46.99 82.1 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -174.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 7.8 Cg_endo -49.04 -66.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.532 2.155 . . . . 0.0 113.796 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.501 HD23 ' H ' ' A' ' 66' ' ' LEU . 2.4 pt? -60.84 -26.97 67.73 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 58.81 -108.67 1.65 Allowed Glycine 0 CA--C 1.533 1.18 0 N-CA-C 115.104 0.802 . . . . 0.0 115.104 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.9 -27.74 66.97 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -170.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.44 ' HB3' ' HG2' ' A' ' 86' ' ' ARG . 79.0 m-20 -73.56 -7.16 50.77 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.1 tp -120.34 117.51 27.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.71 0.291 . . . . 0.0 110.245 174.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -133.45 134.05 43.08 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.14 0.495 . . . . 0.0 112.162 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -81.24 86.89 6.15 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.668 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -75.39 126.22 30.58 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.92 127.68 33.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.988 0.423 . . . . 0.0 111.358 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 87.3 p -74.11 176.64 6.37 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.396 0.617 . . . . 0.0 112.244 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -65.87 -30.05 70.59 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.972 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.96 14.27 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.779 176.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.55 -49.08 0.53 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.616 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.01 142.28 51.67 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -87.28 150.23 24.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.0 0.429 . . . . 0.0 111.728 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -130.48 124.74 21.25 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.268 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.98 99.5 0.4 Allowed 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.514 2.142 . . . . 0.0 112.357 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -98.25 125.13 43.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.447 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.1 tp -95.46 113.75 25.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.679 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -87.6 22.67 2.17 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.245 0.545 . . . . 0.0 111.824 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HG2' ' HB3' ' A' ' 69' ' ' ASP . 31.3 mmt180 -131.97 140.6 38.67 Favored Pre-proline 0 N--CA 1.468 0.44 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.678 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -59.28 118.0 4.82 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 121.921 1.747 . . . . 0.0 110.987 170.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 22' ' ' PHE . 56.4 tp -67.12 87.78 0.16 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.437 0.637 . . . . 0.0 111.578 -172.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.5 mt -60.22 134.18 56.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.591 HG21 ' HA ' ' A' ' 17' ' ' LYS . 79.3 t -60.09 -31.77 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 121.201 0.524 . . . . 0.0 110.695 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.1 m -71.04 -11.94 61.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.481 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.6 -13.79 22.65 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.955 0.407 . . . . 0.0 111.141 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t -76.53 137.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.861 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.688 HG22 ' HG3' ' A' ' 95' ' ' ARG . 22.8 m -76.3 -66.3 0.82 Allowed 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.688 ' HG3' HG22 ' A' ' 94' ' ' THR . 62.1 mtt85 -141.92 152.79 43.87 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.17 125.35 47.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.045 0.45 . . . . 0.0 109.959 171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.42 155.73 30.24 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.3 0.571 . . . . 0.0 112.537 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -98.7 96.1 7.69 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 1.8 pt? -79.24 149.19 31.95 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.334 0.588 . . . . 0.0 112.26 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -86.53 174.35 9.0 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.844 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.713 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 75.1 mt -133.91 86.51 2.29 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.688 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -90.3 166.19 13.46 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.14 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -135.01 26.95 3.57 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.341 0.591 . . . . 0.0 110.44 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.713 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 102.36 22.34 9.87 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.71 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.8 t -98.02 112.65 62.37 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 122.495 -0.415 . . . . 0.0 110.844 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 109' ' ' LEU . 32.4 Cg_exo -59.39 121.94 10.7 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.674 2.249 . . . . 0.0 112.85 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -74.59 75.82 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.523 0.677 . . . . 0.0 111.645 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.621 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.9 mp -73.23 -16.08 61.41 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.946 177.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.95 -36.48 51.16 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.039 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -71.58 -22.58 61.71 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.969 0.414 . . . . 0.0 111.498 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -90.6 -14.38 32.55 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 18.2 mt . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.106 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.2 mt -125.49 144.82 50.37 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.416 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.625 HG21 HD11 ' A' ' 70' ' ' LEU . 17.5 pt -118.71 139.88 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-O 121.158 0.504 . . . . 0.0 111.694 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.429 ' HB3' HD21 ' A' ' 58' ' ' LEU . 20.5 m-85 -124.66 147.46 48.53 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.635 -177.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.612 ' HZ3' ' HE2' ' A' ' 22' ' ' PHE . 87.8 tttt -143.7 119.6 10.62 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.794 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.0 mt -92.22 126.55 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 120.908 0.385 . . . . 0.0 110.884 175.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.436 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -143.37 168.19 20.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.598 -0.273 . . . . 0.0 110.979 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG3' ' A' ' 12' ' ' GLU . 29.0 t -71.25 145.34 49.65 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.977 0.418 . . . . 0.0 111.61 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 10' ' ' ARG . 25.5 tpt85 -56.84 -31.28 64.6 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.965 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.25 -47.2 74.52 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.356 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 43.4 mt-10 -60.07 -42.19 94.03 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.233 0.54 . . . . 0.0 110.893 177.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.511 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 20.0 t-105 -70.22 -36.49 74.6 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.582 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.26 -52.02 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.611 0.72 . . . . 0.0 110.465 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.72 -36.56 79.15 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.521 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.16 -46.89 88.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.957 0.408 . . . . 0.0 111.259 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.3 mttm -56.98 -41.56 78.6 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.632 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.9 -45.8 91.38 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.25 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -67.49 -26.44 66.36 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.037 0.446 . . . . 0.0 111.287 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 90' ' ' VAL . . . 87.35 -2.34 86.5 Favored Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.716 -170.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ptt-85 -160.37 168.6 24.87 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.8 0.334 . . . . 0.0 111.325 -176.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.612 ' HE2' ' HZ3' ' A' ' 6' ' ' LYS . 36.6 t80 -136.12 99.65 4.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.252 0.549 . . . . 0.0 110.111 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -94.44 172.89 7.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.091 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -74.97 140.25 26.4 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.688 -175.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.4 m -81.23 167.27 19.78 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 122.789 -0.242 . . . . 0.0 110.422 174.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.93 -32.65 46.76 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.878 0.37 . . . . 0.0 111.252 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.46 -51.31 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.222 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.09 -51.0 63.26 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.47 -32.38 64.92 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.743 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.27 -44.87 51.05 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.987 0.422 . . . . 0.0 111.59 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.97 -34.27 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.19 0.519 . . . . 0.0 111.21 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 138.9 52.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.929 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 65.46 -168.2 0.21 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 122.917 0.487 . . . . 0.0 111.491 -175.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.5 mt -54.26 104.42 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 121.234 0.54 . . . . 0.0 112.117 -173.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -77.58 115.46 17.36 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.367 0.603 . . . . 0.0 111.757 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.518 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 65.1 mt -101.72 -170.27 1.8 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.814 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.8 p -141.31 156.2 45.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -94.63 -177.64 4.28 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.155 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.4 -78.77 0.1 OUTLIER Glycine 0 CA--C 1.53 1.03 0 N-CA-C 114.028 0.371 . . . . 0.0 114.028 -176.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -63.53 -28.48 69.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.202 -0.587 . . . . 0.0 111.651 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.87 -38.75 89.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.586 0.231 . . . . 0.0 111.562 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.25 -48.31 82.28 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.732 0.301 . . . . 0.0 110.948 175.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 17.7 tp60 -59.55 -51.3 70.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.726 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.683 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 11.7 tp10 -62.58 -52.23 64.2 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.216 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 49.8 m -58.62 -38.07 77.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.878 0.37 . . . . 0.0 111.073 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -61.73 -44.61 96.59 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.823 0.344 . . . . 0.0 111.334 176.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.94 -25.6 64.64 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.683 ' HE2' ' HG3' ' A' ' 44' ' ' GLU . 54.5 mttm -88.44 -51.88 5.48 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -105.48 -43.02 5.06 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -169.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.511 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.1 m-85 -85.06 -2.07 57.57 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -174.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.8 ptt85 -62.36 130.96 47.63 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.087 0.47 . . . . 0.0 111.58 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.39 -7.83 80.53 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.267 -0.492 . . . . 0.0 113.457 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.442 ' HB2' HD11 ' A' ' 56' ' ' LEU . 70.4 mt-30 -91.36 116.75 29.09 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.229 -0.571 . . . . 0.0 111.022 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.66 155.76 19.41 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.897 0.38 . . . . 0.0 111.391 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 63.37 73.0 0.46 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.47 0.652 . . . . 0.0 111.435 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 53' ' ' GLN . 97.1 mt -120.76 154.3 35.85 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.804 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.1 t -128.78 138.74 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.939 0.4 . . . . 0.0 111.257 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 5' ' ' TYR . 5.9 tt -112.95 108.69 17.71 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.973 0.416 . . . . 0.0 109.941 176.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.15 110.98 17.17 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.205 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.444 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.83 117.38 34.22 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.51 130.88 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 120.96 0.409 . . . . 0.0 111.667 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.17 108.52 14.89 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.053 0.454 . . . . 0.0 110.848 176.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.83 52.94 2.61 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -169.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.526 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 44.5 mt-10 -80.92 -58.32 0.53 Allowed Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.914 -0.491 . . . . 0.0 111.975 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 83.1 Cg_endo -76.68 -38.72 0.86 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 122.07 1.847 . . . . 0.0 113.338 -178.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.586 HD23 ' H ' ' A' ' 66' ' ' LEU . 2.5 pt? -98.57 21.66 10.95 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.185 0.517 . . . . 0.0 111.561 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.52 -11.14 40.11 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 115.0 0.76 . . . . 0.0 115.0 -174.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -121.5 4.69 10.16 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 117.753 0.777 . . . . 0.0 111.49 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.589 ' HB3' ' HD3' ' A' ' 86' ' ' ARG . 2.3 m-20 -80.45 -1.94 43.67 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 111.008 175.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.625 HD11 HG21 ' A' ' 4' ' ' ILE . 2.7 pt? -137.07 163.83 29.85 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.026 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -123.79 126.22 46.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.997 0.427 . . . . 0.0 111.92 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -80.29 82.73 6.28 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.174 0.512 . . . . 0.0 110.315 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -77.94 98.24 5.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.328 0.585 . . . . 0.0 112.178 -175.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -92.16 67.72 5.05 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.546 0.689 . . . . 0.0 110.006 172.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 79.8 p -129.37 -73.13 0.57 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.612 -176.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -70.27 102.38 2.11 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.773 0.32 . . . . 0.0 111.191 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.91 -19.4 41.16 Favored Glycine 0 CA--C 1.525 0.698 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.046 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.65 -33.74 4.85 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 121.279 -0.486 . . . . 0.0 113.987 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -77.72 169.46 18.26 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.113 0.483 . . . . 0.0 112.015 -178.288 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -83.28 110.19 17.89 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -115.26 105.71 52.12 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.518 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 44.7 Cg_endo -71.76 114.26 3.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.564 2.176 . . . . 0.0 112.694 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -108.74 118.6 37.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.879 175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.413 HD22 ' H ' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -90.94 116.07 28.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.069 0.462 . . . . 0.0 110.43 178.688 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -87.14 9.32 20.31 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.023 0.44 . . . . 0.0 111.771 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 69' ' ' ASP . 35.1 mtp85 -129.52 149.41 72.79 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.065 -176.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.62 132.14 28.04 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.635 2.224 . . . . 0.0 112.701 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 93' ' ' VAL . 10.1 tt -89.6 106.32 18.38 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.9 mt -74.46 138.55 43.31 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.256 -0.277 . . . . 0.0 110.369 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 20' ' ' GLY . 26.2 m -61.19 -31.46 50.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.862 -0.524 . . . . 0.0 111.763 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 84.9 p -67.47 -12.28 59.92 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.67 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -90.65 -21.57 21.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.578 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 88' ' ' LEU . 48.7 t -62.21 118.15 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.694 0.283 . . . . 0.0 111.687 -176.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 87.8 m -58.45 -56.38 22.9 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.017 0.437 . . . . 0.0 111.125 177.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -145.0 144.63 31.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.219 0.533 . . . . 0.0 111.483 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -116.5 103.53 10.51 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.39 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -91.03 107.39 19.17 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.761 0.315 . . . . 0.0 111.827 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.65 111.35 4.74 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.08 119.33 9.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.471 0.653 . . . . 0.0 112.43 -173.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -71.73 -42.17 67.62 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.614 -176.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.4 mt 68.27 132.79 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.246 0.618 . . . . 0.0 111.836 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -140.09 162.29 35.59 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.272 0.558 . . . . 0.0 111.896 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.19 -79.82 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -105.21 11.97 32.44 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -171.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 71.89 30.08 66.3 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.026 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.78 142.3 26.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.123 0.569 . . . . 0.0 109.999 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.441 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 13.0 Cg_exo -71.99 103.72 1.53 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 122.13 1.887 . . . . 0.0 112.68 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -80.88 80.83 7.28 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.16 0.505 . . . . 0.0 111.643 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.9 mp -66.11 -26.67 67.56 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 122.048 -0.408 . . . . 0.0 110.864 174.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.28 -23.05 46.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.338 -0.458 . . . . 0.0 113.333 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -98.76 -11.73 21.61 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 122.463 -0.433 . . . . 0.0 111.584 175.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -88.8 -37.95 15.02 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.808 0.337 . . . . 0.0 111.502 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 14.0 mt . . . . . 0 CA--C 1.541 0.62 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.301 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.97 123.54 46.06 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.864 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.619 HD12 HD13 ' A' ' 36' ' ' LEU . 13.1 pt -108.71 153.75 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -177.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 94.9 m-85 -131.85 163.11 28.99 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.583 0.706 . . . . 0.0 112.536 -176.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HZ3' HD23 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -157.95 115.56 3.0 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 177.198 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.5 mt -102.38 127.43 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.613 0.244 . . . . 0.0 111.339 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.444 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -151.92 166.0 32.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.916 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 m -69.46 146.71 51.74 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 122.3 -0.25 . . . . 0.0 111.67 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -57.25 -52.2 66.3 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.46 -39.76 64.73 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.162 0.506 . . . . 0.0 111.409 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -67.11 -36.33 81.69 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.847 177.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -64.28 -48.49 75.48 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.221 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.28 -30.22 69.32 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.53 0.205 . . . . 0.0 111.375 176.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.05 -60.19 3.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.989 0.423 . . . . 0.0 110.882 174.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.21 -35.22 69.37 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 111.266 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HA ' HG21 ' A' ' 90' ' ' VAL . 26.5 ttpp -69.92 -31.87 69.87 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.395 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.87 -21.7 61.62 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.303 0.573 . . . . 0.0 111.037 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -87.74 -23.13 24.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.971 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.95 -2.74 63.64 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 121.275 -0.488 . . . . 0.0 112.117 -172.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.568 ' HG3' HD23 ' A' ' 89' ' ' LEU . 54.0 ttp180 -143.13 141.53 31.23 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.006 0.431 . . . . 0.0 111.663 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -110.16 109.67 20.27 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.627 176.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -122.56 90.33 3.28 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.615 0.721 . . . . 0.0 112.226 179.057 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA2' ' HB2' ' A' ' 28' ' ' ASP . . . 65.98 101.62 0.02 OUTLIER Glycine 0 CA--C 1.533 1.194 0 N-CA-C 115.671 1.028 . . . . 0.0 115.671 171.311 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.2 m -76.75 177.9 7.22 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 167.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.06 -46.45 33.5 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.112 0.482 . . . . 0.0 112.294 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.0 t -70.06 -44.59 78.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.739 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HA2' ' A' ' 24' ' ' GLY . 5.2 m-20 -64.35 -27.5 69.06 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.87 0.367 . . . . 0.0 111.481 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.48 -36.3 73.77 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.312 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.16 -49.0 77.6 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.741 172.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.04 -28.17 69.4 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.623 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.82 -45.96 3.09 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -175.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -116.68 145.26 43.56 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -52.8 114.67 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -176.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -90.45 107.96 19.48 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.813 0.816 . . . . 0.0 110.532 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.684 HD23 ' HZ3' ' A' ' 6' ' ' LYS . 35.0 mt -89.45 54.88 3.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.522 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -45.87 107.12 0.09 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.897 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -103.31 147.05 27.56 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.6 -113.43 3.08 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 115.541 -0.754 . . . . 0.0 114.667 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -54.89 -47.67 74.02 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -59.81 -39.97 86.84 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.757 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.36 -56.55 19.09 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.939 0.399 . . . . 0.0 111.445 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -61.74 -49.7 75.36 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.8 -22.38 66.98 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -176.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.0 m -81.0 -40.5 24.22 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.21 0.529 . . . . 0.0 110.311 171.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.57 74.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.278 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.58 -24.57 67.62 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -100.31 -56.54 2.33 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.129 0.49 . . . . 0.0 111.971 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -78.6 -37.72 41.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -109.25 8.85 25.9 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -172.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.25 136.62 58.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.979 0.419 . . . . 0.0 111.654 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.66 -26.02 16.14 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.404 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -85.82 116.23 23.95 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 122.534 -0.392 . . . . 0.0 111.424 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB1' ' HA ' ' A' ' 100' ' ' ASP . . . -103.89 -0.46 29.05 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -92.03 15.78 12.59 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.65 159.08 18.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -177.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.7 143.34 38.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.988 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.0 tt -98.68 133.57 42.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.796 0.331 . . . . 0.0 110.967 175.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.4 mt -104.94 130.01 53.21 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.322 0.249 . . . . 0.0 110.975 177.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -118.84 122.19 41.78 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.721 0.296 . . . . 0.0 110.915 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.2 t -133.84 137.88 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.735 0.302 . . . . 0.0 111.562 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -77.19 127.65 32.99 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 170.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -52.36 64.12 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -175.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.481 ' HG3' ' HD2' ' A' ' 65' ' ' PRO . 35.0 tt0 69.43 141.52 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.921 0 C-N-CA 122.885 0.474 . . . . 0.0 110.874 -173.027 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 24.4 Cg_endo -61.59 77.45 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.575 2.184 . . . . 0.0 112.65 177.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.4 mt -72.64 -59.38 2.75 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.661 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.78 -118.71 0.79 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.365 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -130.38 18.26 5.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 122.381 -0.482 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -79.37 -36.6 39.04 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.83 0.348 . . . . 0.0 111.554 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -81.55 101.82 10.21 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.254 0.549 . . . . 0.0 110.804 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HD3' ' CE1' ' A' ' 85' ' ' TYR . 48.9 mtpt -95.67 109.87 22.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.136 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.535 ' CZ3' ' HG3' ' A' ' 82' ' ' PRO . 78.1 m95 -74.25 73.38 1.8 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.717 0.77 . . . . 0.0 109.256 167.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -90.15 117.5 28.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.246 -169.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -86.71 132.8 33.77 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 176.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.2 t -145.52 178.89 7.79 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 62.97 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.903 0.481 . . . . 0.0 111.7 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.32 23.65 0.44 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.38 -158.64 26.98 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.982 -0.447 . . . . 0.0 111.982 -176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 62.87 111.42 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.253 0.549 . . . . 0.0 112.371 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 -82.16 93.4 7.05 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.938 0.399 . . . . 0.0 111.63 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -78.86 113.98 39.99 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.515 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 12.3 Cg_exo -69.61 88.31 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.464 2.109 . . . . 0.0 112.494 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -88.52 106.49 18.32 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.5 tp -92.05 122.65 34.75 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.05 0.453 . . . . 0.0 111.229 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 71' ' ' LYS . 2.0 m-85 -86.43 21.18 2.18 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.471 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 12.1 mtm180 -132.6 143.15 47.55 Favored Pre-proline 0 N--CA 1.473 0.709 0 O-C-N 122.048 -0.408 . . . . 0.0 111.278 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.41 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 21.9 Cg_exo -65.87 111.12 1.85 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.299 1.999 . . . . 0.0 111.447 172.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.45 114.12 10.23 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.802 -170.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.568 HD23 ' HG3' ' A' ' 21' ' ' ARG . 71.0 mt -73.26 142.28 47.24 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.745 0.307 . . . . 0.0 111.155 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.622 HG21 ' HA ' ' A' ' 17' ' ' LYS . 86.1 t -59.08 -31.39 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.304 0.573 . . . . 0.0 111.06 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.6 p -73.79 -10.83 60.08 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.17 176.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 89' ' ' LEU . 55.3 mt-10 -89.22 -18.31 27.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.852 0.358 . . . . 0.0 110.556 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.1 t -72.52 127.45 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.409 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 89.0 m -73.33 -65.22 0.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.1 ptt-85 -148.18 154.56 40.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.812 0.339 . . . . 0.0 111.767 -174.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.62 174.19 5.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.043 0.449 . . . . 0.0 110.768 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -152.72 98.17 2.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.808 0.337 . . . . 0.0 111.601 178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.08 136.56 39.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.511 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.506 ' N ' HD23 ' A' ' 99' ' ' LEU . 1.5 pt? -141.06 97.52 3.19 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.635 0.731 . . . . 0.0 112.172 -177.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.439 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t70 -84.64 127.93 34.34 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.498 173.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -155.28 -171.54 3.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.05 0.452 . . . . 0.0 111.932 -171.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -142.48 -168.07 2.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.755 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.18 -0.73 15.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -175.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -133.56 -31.79 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -54.25 -53.41 37.9 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 110.531 -1.027 . . . . 0.0 110.531 164.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' HD2' ' A' ' 107' ' ' PRO . 2.1 t 65.68 146.04 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 170.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.553 ' HD2' HG13 ' A' ' 106' ' ' VAL . 24.1 Cg_exo -33.31 99.37 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.25 0 C-N-CA 123.756 2.97 . . . . 0.0 114.613 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -76.26 78.66 3.04 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.609 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.5 mp -100.19 -16.89 17.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.3 -27.96 48.65 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.246 -0.502 . . . . 0.0 113.921 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.95 -9.79 33.01 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 38.5 m80 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 23.2 mt . . . . . 0 CA--C 1.538 0.49 0 CA-C-O 121.017 0.437 . . . . 0.0 111.38 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.78 0.324 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 89.2 mt -115.64 122.54 45.91 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.878 0.37 . . . . 0.0 110.817 177.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 36' ' ' LEU . 23.6 pt -102.51 149.38 7.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.033 0.444 . . . . 0.0 111.458 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.443 ' HB3' HD11 ' A' ' 58' ' ' LEU . 80.3 m-85 -142.65 121.67 12.85 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.772 -174.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HD2' HD23 ' A' ' 36' ' ' LEU . 79.6 tttt -110.48 125.29 53.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.921 0.391 . . . . 0.0 110.896 176.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.461 HD11 HD21 ' A' ' 109' ' ' LEU . 65.9 mt -98.29 132.49 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.342 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.439 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.2 pt? -145.78 171.06 15.33 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.687 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.4 p -77.85 148.92 34.43 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.127 0.489 . . . . 0.0 111.324 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -56.72 -36.1 69.31 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.5 -49.03 75.9 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.3 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -70.0 -40.85 75.03 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.505 ' HZ2' ' HG2' ' A' ' 96' ' ' GLU . 41.3 t-105 -63.4 -40.01 96.06 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.509 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 4.7 t0 -62.93 -43.84 97.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.246 0.546 . . . . 0.0 110.039 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.08 -46.08 85.86 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.513 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.62 89.49 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.208 0.527 . . . . 0.0 111.07 175.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.509 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 25.5 ttpp -60.75 -44.14 97.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.984 175.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -38.4 89.89 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.196 0.522 . . . . 0.0 111.352 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -74.39 -29.13 61.41 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.442 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.1 5.05 89.11 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.736 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.418 HH21 ' CD ' ' A' ' 23' ' ' GLU . 57.2 mtp180 -146.28 134.9 22.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.791 0.436 . . . . 0.0 111.278 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -102.11 98.44 8.61 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.449 0.643 . . . . 0.0 110.008 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.418 ' CD ' HH21 ' A' ' 21' ' ' ARG . 34.8 mm-40 -80.49 -176.05 5.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.23 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.12 116.81 8.86 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.176 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.4 p -74.21 -174.17 1.87 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.498 -0.413 . . . . 0.0 110.681 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.74 -37.21 65.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.01 0.433 . . . . 0.0 111.12 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.3 t -77.94 -47.22 25.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.11 0.481 . . . . 0.0 111.705 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.65 -43.1 99.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.174 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.63 -28.63 62.87 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.88 73.03 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.046 0.45 . . . . 0.0 110.909 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.51 -31.11 53.28 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.375 173.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.16 -12.45 48.59 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.365 -0.379 . . . . 0.0 112.531 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -141.55 151.51 43.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.997 0.519 . . . . 0.0 111.01 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.416 HG23 ' NZ ' ' A' ' 6' ' ' LYS . 55.1 mt -69.85 135.27 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -171.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -87.2 145.95 26.2 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.899 173.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.613 HD11 HD12 ' A' ' 84' ' ' LEU . 78.5 mt -134.64 -69.76 0.51 Allowed 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.552 ' OG ' ' HB2' ' A' ' 41' ' ' GLN . 39.9 t 76.89 165.25 0.25 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.484 0.714 . . . . 0.0 112.343 -175.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' ILE . . . -111.05 176.63 4.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.532 176.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.27 -44.19 7.68 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.441 0.536 . . . . 0.0 114.441 -177.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.06 -66.27 0.41 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.008 0.432 . . . . 0.0 111.929 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.552 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 20.8 mt-30 -76.11 -15.61 60.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -176.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.96 64.88 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.777 0.322 . . . . 0.0 110.686 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.568 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 12.4 tt0 -66.74 -35.73 80.8 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.217 175.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.646 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 63.7 mm-40 -55.21 -60.94 2.69 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.998 0.428 . . . . 0.0 110.724 173.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -54.71 -40.13 68.91 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.449 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -61.71 -41.04 97.08 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.466 176.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.85 -37.56 64.76 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.646 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 48.8 mttm -78.98 -61.52 1.99 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.02 0.438 . . . . 0.0 111.9 -178.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.55 -40.67 16.04 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -107.57 35.39 3.1 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 122.303 -0.248 . . . . 0.0 111.617 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -24.01 -51.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.711 1.204 . . . . 0.0 113.955 -174.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.53 50.14 0.46 Allowed Glycine 0 CA--C 1.525 0.695 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.731 177.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.564 ' HB2' HD21 ' A' ' 56' ' ' LEU . 77.6 mm-40 -77.46 124.74 28.3 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.544 -0.386 . . . . 0.0 111.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.46 68.25 4.85 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.128 0.489 . . . . 0.0 112.095 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -175.39 22.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.303 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 53' ' ' GLN . 42.1 mt -84.21 141.02 31.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.396 0.617 . . . . 0.0 112.288 -173.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.1 t -123.47 128.59 74.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.381 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.443 HD11 ' HB3' ' A' ' 5' ' ' TYR . 52.7 tp -95.82 114.03 25.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.299 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.2 mt -91.56 105.8 18.01 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.805 0.336 . . . . 0.0 110.96 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.69 112.73 24.66 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.479 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 93' ' ' VAL . 20.7 t -130.59 137.36 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.949 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.83 133.74 39.26 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 173.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.37 -74.09 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 59.18 161.52 0.09 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -59.73 -62.13 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.119 1.879 . . . . 0.0 112.182 169.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.3 pp 34.61 33.71 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.98 121.42 4.91 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.849 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.83 -1.12 0.56 Allowed 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -61.02 -25.43 66.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.761 0.315 . . . . 0.0 111.329 174.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.79 106.14 16.81 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.911 0.386 . . . . 0.0 110.295 174.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 73' ' ' GLU . 78.3 tttt -125.86 128.39 47.55 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -174.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 75.0 m95 -79.38 105.6 10.81 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.213 -0.304 . . . . 0.0 111.238 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG2' ' HE2' ' A' ' 71' ' ' LYS . 44.3 mt-10 -118.46 131.08 56.27 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 111.784 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.457 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -94.26 115.68 27.96 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.2 t -75.89 173.61 10.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.24 0.543 . . . . 0.0 112.168 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -64.94 98.03 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.476 0.655 . . . . 0.0 111.599 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 147.49 -33.13 1.33 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.134 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.23 -28.23 3.67 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.45 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -57.73 123.98 17.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.457 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 68.4 mtm180 -97.6 96.85 8.57 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.279 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 68.3 m-85 -104.95 112.81 65.26 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 27.9 Cg_endo -64.16 108.3 0.94 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.079 1.853 . . . . 0.0 111.748 173.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -90.47 126.15 35.81 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.348 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -96.45 112.69 24.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.419 178.46 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -78.69 3.29 16.87 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 120.794 0.331 . . . . 0.0 111.616 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.431 ' HB3' HD22 ' A' ' 84' ' ' LEU . 7.1 tpp180 -119.29 140.1 28.54 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 122.929 0.492 . . . . 0.0 110.635 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -53.19 139.08 63.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.45 2.1 . . . . 0.0 112.484 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.407 HD12 HD21 ' A' ' 36' ' ' LEU . 6.0 tt -88.81 107.11 18.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.188 0.518 . . . . 0.0 111.049 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.547 ' HB2' ' HG2' ' A' ' 92' ' ' GLU . 50.8 mt -79.35 130.79 35.78 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.54 -22.88 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 O-C-N 121.845 -0.534 . . . . 0.0 111.808 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 58.6 m -66.97 -15.97 64.05 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.532 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.547 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 51.4 mm-40 -81.51 -18.32 45.51 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.546 ' HA ' HG22 ' A' ' 61' ' ' VAL . 59.6 t -70.87 117.96 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 120.961 0.41 . . . . 0.0 111.879 -176.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.5 m -60.8 -46.95 88.5 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.966 0.413 . . . . 0.0 111.33 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -159.19 148.52 18.57 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.748 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.505 ' HG2' ' HZ2' ' A' ' 13' ' ' TRP . 0.4 OUTLIER -134.02 154.84 50.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.657 0.265 . . . . 0.0 111.14 177.719 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -166.82 150.05 6.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.878 0.37 . . . . 0.0 111.737 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -66.27 123.73 20.75 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.552 HD21 HD11 ' A' ' 109' ' ' LEU . 54.2 tp -78.31 128.55 33.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.585 -174.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -92.26 156.34 17.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.971 0.415 . . . . 0.0 111.306 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 73.7 mt -100.31 174.69 6.01 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.241 0.543 . . . . 0.0 112.016 -175.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.481 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 31.4 t70 -100.95 173.27 6.56 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.346 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.07 -33.16 37.97 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.948 0.404 . . . . 0.0 111.601 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.83 -28.98 24.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.254 0.549 . . . . 0.0 110.633 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.04 -23.78 6.46 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.605 -174.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.3 t -59.24 119.21 36.93 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.448 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 33.9 Cg_exo -59.19 111.32 0.88 Allowed 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 122.538 2.159 . . . . 0.0 112.817 177.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.481 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 85.2 mm-40 -88.79 84.86 6.68 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.299 0.571 . . . . 0.0 112.355 -175.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 43' ' ' GLN . 7.5 mp -81.94 -35.64 28.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.495 177.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.76 -34.73 29.62 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.949 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.47 -33.38 21.87 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.876 0.369 . . . . 0.0 111.415 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.65 -27.13 65.72 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 48.9 mt . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 121.196 0.522 . . . . 0.0 112.108 -175.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 61.6 m . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 121.099 0.476 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -76.75 111.83 12.69 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.9 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 36' ' ' LEU . 6.9 pt -96.32 135.14 31.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.08 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 71.7 m-85 -116.09 155.96 27.24 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -172.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 63.0 tttp -154.82 129.65 9.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.627 174.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.55 120.62 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 120.605 0.241 . . . . 0.0 110.931 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -135.49 158.48 44.26 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.838 0.351 . . . . 0.0 111.237 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 p -69.92 151.36 45.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.211 0.529 . . . . 0.0 112.088 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -58.81 -60.69 3.44 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.54 -33.79 64.12 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -69.41 -38.82 78.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.897 0.379 . . . . 0.0 111.088 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 44.1 t-105 -64.67 -46.48 82.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.812 0.339 . . . . 0.0 110.77 174.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.6 -37.06 84.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 176.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.528 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -61.76 -53.63 53.43 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.968 0.413 . . . . 0.0 110.828 175.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.32 -37.64 78.28 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.162 0.506 . . . . 0.0 111.311 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HA ' HG21 ' A' ' 90' ' ' VAL . 25.7 ttpp -67.42 -33.74 75.8 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.05 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.04 -36.43 79.91 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.267 0.556 . . . . 0.0 110.676 173.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 76.2 mm-40 -74.36 -29.45 61.57 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.0 175.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.79 2.97 74.62 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 115.993 -0.548 . . . . 0.0 112.587 -175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -154.19 129.0 9.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 111.62 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 65.1 t80 -95.92 97.9 9.99 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.172 0.51 . . . . 0.0 110.204 173.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.25 -36.67 71.85 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.132 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.44 157.7 7.66 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.533 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -84.47 170.05 13.89 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.396 0.279 . . . . 0.0 110.916 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.86 -43.8 69.84 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.074 0.464 . . . . 0.0 111.405 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.9 t -61.82 -32.37 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.503 176.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.527 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 71.1 m-20 -72.89 -49.89 27.05 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.943 0.401 . . . . 0.0 111.226 179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.43 -34.69 78.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.809 0.337 . . . . 0.0 111.618 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.52 78.6 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.083 0.468 . . . . 0.0 111.485 176.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.74 -38.93 37.65 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.008 0.432 . . . . 0.0 111.53 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.86 -20.55 28.98 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.887 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -129.59 160.23 33.91 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.685 0.394 . . . . 0.0 110.48 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.556 ' O ' HG22 ' A' ' 34' ' ' ILE . 32.7 mt -75.86 12.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 32.0 m-70 49.59 88.74 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.654 -0.654 . . . . 0.0 112.356 -178.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 4' ' ' ILE . 73.0 mt -117.45 155.88 28.93 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 122.156 -0.34 . . . . 0.0 110.628 176.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -141.9 149.03 39.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.67 -179.9 4.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.143 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -48.3 -63.3 3.76 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 121.463 -0.399 . . . . 0.0 114.054 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -55.6 -50.03 71.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.248 0.546 . . . . 0.0 111.674 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -60.89 -33.42 73.08 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.862 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.76 -44.74 66.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.012 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.48 -35.79 81.93 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.181 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.14 -56.87 11.78 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.895 0.378 . . . . 0.0 110.296 174.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 97.0 m -55.02 -31.62 61.2 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.274 176.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.83 -58.73 4.94 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.899 0.38 . . . . 0.0 111.176 175.131 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.81 69.01 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -87.54 -45.62 10.3 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -112.39 -52.11 2.8 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.587 ' HB3' HE22 ' A' ' 53' ' ' GLN . 97.1 m-85 -102.45 60.18 0.82 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.677 0.751 . . . . 0.0 111.521 -170.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -106.4 3.37 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.43 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -113.9 60.06 0.38 Allowed Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.916 171.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.587 HE22 ' HB3' ' A' ' 50' ' ' PHE . 6.8 mm-40 -73.69 110.07 7.7 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.9 -66.82 1.02 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -137.1 61.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.549 0.69 . . . . 0.0 110.902 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.416 HD21 ' OE1' ' A' ' 53' ' ' GLN . 0.9 OUTLIER -130.19 -179.96 5.54 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.171 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.9 t -134.86 147.37 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.98 0.419 . . . . 0.0 111.675 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 70.2 tp -101.32 108.88 20.63 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.657 174.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.8 mt -84.75 147.84 26.66 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.887 0.375 . . . . 0.0 111.701 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.529 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -141.39 131.48 24.73 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 176.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.7 t -136.59 141.7 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -74.44 120.49 20.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.723 0.409 . . . . 0.0 111.15 173.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.538 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.61 -35.09 53.15 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -56.91 -55.28 45.33 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -173.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.43 0.11 9.46 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.141 1.894 . . . . 0.0 114.301 -170.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.28 -49.82 68.07 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 122.14 -0.35 . . . . 0.0 111.72 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.3 42.01 0.48 Allowed Glycine 0 CA--C 1.525 0.697 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.701 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 55.65 20.41 3.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.544 ' HB3' ' HG3' ' A' ' 86' ' ' ARG . 8.8 m-20 -70.7 -16.07 62.76 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.983 0.42 . . . . 0.0 111.85 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 82' ' ' PRO . 39.4 tp -90.21 112.0 23.36 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.887 0.375 . . . . 0.0 110.929 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HD2' ' HB2' ' A' ' 73' ' ' GLU . 3.7 tmtp? -95.61 104.27 16.18 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.862 0.363 . . . . 0.0 110.904 -178.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -69.55 94.33 0.75 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 110.022 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.562 ' HB2' ' HD2' ' A' ' 71' ' ' LYS . 11.7 tp10 -122.27 138.39 54.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.773 -169.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -83.32 176.47 9.1 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.37 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.1 t -168.42 -171.58 1.5 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.161 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 76' ' ' ARG . 39.7 mtp85 -54.07 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 111.467 -179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 144.36 -16.98 2.08 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.489 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.22 -4.17 77.9 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.902 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -95.6 129.44 42.8 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.387 -0.478 . . . . 0.0 111.936 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 87.5 mtt180 -80.29 109.46 14.79 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.978 0.418 . . . . 0.0 111.3 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -98.58 139.06 20.87 Favored Pre-proline 0 C--O 1.239 0.528 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 176.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.536 ' HB2' HD11 ' A' ' 70' ' ' LEU . 28.8 Cg_endo -63.24 97.22 0.19 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.279 1.986 . . . . 0.0 112.126 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -91.14 104.94 17.45 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.053 0.454 . . . . 0.0 111.995 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.429 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 51.3 tp -97.46 122.5 40.58 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.726 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -106.26 16.88 24.26 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.209 0.528 . . . . 0.0 111.424 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HG3' ' HB3' ' A' ' 69' ' ' ASP . 18.7 mmm180 -112.03 130.78 22.91 Favored Pre-proline 0 N--CA 1.47 0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.83 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.29 116.32 2.88 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.658 2.239 . . . . 0.0 112.709 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 50.0 tp -74.13 95.26 2.54 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 121.072 0.463 . . . . 0.0 111.622 -175.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.3 mt -59.67 122.9 15.27 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.532 HG21 ' HA ' ' A' ' 17' ' ' LYS . 83.0 t -61.58 -34.1 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.875 0.369 . . . . 0.0 111.966 -176.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -72.74 0.32 11.15 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -118.56 -1.15 11.23 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.866 0.365 . . . . 0.0 111.302 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 90' ' ' VAL . 79.8 t -74.3 139.26 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 122.183 -0.323 . . . . 0.0 111.539 -179.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 37.0 m -69.36 -59.44 2.99 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 95' ' ' ARG . 1.9 mmp_? -147.07 151.1 36.33 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 8.0 pt-20 -129.92 95.91 4.07 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.891 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.56 132.07 44.27 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.99 149.92 41.02 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.68 171.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.511 ' N ' HD23 ' A' ' 99' ' ' LEU . 1.9 pt? -150.85 146.22 26.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.094 0.473 . . . . 0.0 112.091 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -127.71 -161.49 1.09 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.81 177.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.43 HD11 ' HA2' ' A' ' 52' ' ' GLY . 98.1 mt -117.22 135.74 53.57 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -143.72 -175.55 4.62 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.665 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.83 -78.19 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 177.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -139.13 17.92 2.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.651 0.739 . . . . 0.0 110.223 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 100.2 32.47 5.53 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.093 -173.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.6 t -116.95 132.2 23.56 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 122.52 0.328 . . . . 0.0 110.665 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -79.17 77.3 4.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.865 1.71 . . . . 0.0 111.163 171.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -70.07 83.72 0.51 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 122.733 1.254 . . . . 0.0 111.577 -174.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 6.39 0.27 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.256 -1.338 . . . . 0.0 113.216 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.32 -25.97 4.61 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.431 -0.414 . . . . 0.0 113.644 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.5 -36.65 84.87 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.596 0.713 . . . . 0.0 110.658 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -76.7 -23.91 53.12 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.335 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.8 mt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 120.917 0.389 . . . . 0.0 111.76 -174.099 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.2 mt -125.66 150.99 47.14 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.5 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -125.02 149.8 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 120.726 0.298 . . . . 0.0 110.757 174.179 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.421 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.1 m-85 -130.9 141.46 50.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 35' ' ' HIS . 24.9 ttmm -134.91 127.45 30.66 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.999 173.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.4 mp -101.3 130.74 50.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -154.94 166.27 34.08 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.789 177.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 57.4 p -78.46 143.15 36.95 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 122.185 -0.322 . . . . 0.0 110.381 178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' HB3' ' A' ' 13' ' ' TRP . 79.7 ttt180 -60.97 -25.2 66.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.0 -32.15 67.64 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.03 0.443 . . . . 0.0 111.288 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -89.51 -34.82 16.26 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.244 0.545 . . . . 0.0 110.982 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 15.8 t-105 -62.02 -53.92 48.8 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.885 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.59 -30.4 67.17 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.084 0.469 . . . . 0.0 110.191 172.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.7 -48.84 79.75 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.633 177.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HA ' HG21 ' A' ' 90' ' ' VAL . 56.7 mtmt -62.16 -30.9 71.37 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.58 -36.89 63.05 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.12 0.486 . . . . 0.0 110.976 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -71.66 -25.74 62.25 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.769 177.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 -15.69 53.71 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.206 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.548 ' NH2' ' HG2' ' A' ' 87' ' ' PRO . 49.4 ttt180 -140.03 147.2 40.02 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.115 0.483 . . . . 0.0 111.461 -177.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -116.46 88.05 2.81 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.793 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.73 -15.43 62.82 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.027 0.441 . . . . 0.0 111.313 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.69 175.49 13.95 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.993 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.6 p -75.3 -176.94 3.29 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 122.634 -0.333 . . . . 0.0 110.457 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.58 62.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.222 0.534 . . . . 0.0 110.637 172.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.3 t -78.04 -52.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.583 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -58.02 -42.32 85.05 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.925 0.393 . . . . 0.0 111.245 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.65 -35.16 74.94 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.338 179.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.0 -51.72 68.49 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 110.917 175.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.37 -34.9 76.88 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.138 0.494 . . . . 0.0 111.485 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.52 -40.42 2.59 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.394 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -98.17 117.91 33.6 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.488 0.315 . . . . 0.0 110.827 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.538 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 64.5 mt -64.78 122.42 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.413 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 47.4 m-70 -83.58 124.85 31.19 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.365 175.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.698 HD13 HG13 ' A' ' 4' ' ' ILE . 98.9 mt -113.35 -64.42 1.31 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.485 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 26.5 m 73.46 154.95 0.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.207 0.527 . . . . 0.0 111.85 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.08 -176.63 5.2 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.07 -64.73 3.91 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 114.285 0.474 . . . . 0.0 114.285 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 9.7 mp0 -56.54 -47.59 79.1 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 117.082 0.441 . . . . 0.0 111.117 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 29.9 mt-30 -57.09 -35.77 69.8 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.968 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.31 -48.87 60.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.871 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.689 ' HB2' HD22 ' A' ' 109' ' ' LEU . 28.9 tt0 -65.86 -34.95 79.33 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.365 -0.209 . . . . 0.0 111.488 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.1 mt-10 -64.42 -51.08 64.99 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 175.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 m -60.2 -40.31 89.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.248 0.547 . . . . 0.0 110.463 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.638 ' HB1' ' HG2' ' A' ' 51' ' ' ARG . . . -61.43 -47.41 85.86 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.709 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' HB2' HG11 ' A' ' 106' ' ' VAL . . . -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.315 0.578 . . . . 0.0 111.973 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.36 -41.81 14.2 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.684 -176.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.8 -6.04 13.86 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -166.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -144.71 -69.65 0.29 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.638 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.4 mmt180 -57.99 93.0 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.719 0.771 . . . . 0.0 112.918 -173.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.41 26.93 0.05 OUTLIER Glycine 0 CA--C 1.525 0.685 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.01 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -165.8 176.47 7.92 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.747 0.308 . . . . 0.0 111.627 -174.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.81 166.98 14.2 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' SER . 87.6 m-20 65.08 19.48 11.82 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 175.063 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.494 ' H ' HD13 ' A' ' 99' ' ' LEU . 65.1 mt -84.81 93.47 8.49 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.97 139.62 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.179 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.423 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 63.3 tp -107.4 99.92 9.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 74.2 mt -75.96 105.36 6.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.983 0.42 . . . . 0.0 111.027 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.21 102.6 12.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.767 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -105.2 139.82 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.802 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 94' ' ' THR . 4.2 mm-40 -79.29 115.33 18.88 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.554 0.216 . . . . 0.0 110.741 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.43 21.36 1.19 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.326 0.584 . . . . 0.0 111.192 177.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.59 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 32.6 tt0 -71.17 -41.1 10.21 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -176.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 11.7 Cg_endo -55.71 -67.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 121.742 1.628 . . . . 0.0 111.865 173.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.84 58.56 5.33 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 121.122 0.487 . . . . 0.0 112.278 171.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -98.43 -109.41 2.87 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.364 -0.446 . . . . 0.0 112.448 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 14.58 27.21 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.618 0.723 . . . . 0.0 110.558 173.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.568 ' HA ' HH11 ' A' ' 86' ' ' ARG . 0.8 OUTLIER -89.88 -69.54 0.71 Allowed 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.165 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.505 HD13 HD12 ' A' ' 36' ' ' LEU . 58.7 tp -100.29 134.54 43.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -176.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -124.39 128.34 48.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.756 0.312 . . . . 0.0 111.639 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -74.0 106.59 5.76 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.09 136.6 51.41 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -132.72 102.98 5.89 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -176.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 78.9 p -54.59 -48.28 72.33 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.154 0.502 . . . . 0.0 111.577 175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -80.38 5.57 14.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.402 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.72 -67.13 3.6 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.158 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.51 144.71 29.56 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.899 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 66.14 95.93 0.06 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.168 0.509 . . . . 0.0 111.19 -175.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.82 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 68.7 mtp180 -87.31 117.53 26.14 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.815 -172.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.409 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 65.4 m-85 -90.07 113.08 55.89 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 81' ' ' PHE . 19.5 Cg_endo -60.52 115.05 2.41 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.959 1.773 . . . . 0.0 112.052 174.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -115.63 136.88 52.62 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.933 0.397 . . . . 0.0 111.453 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.538 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 38.1 tp -98.44 107.13 19.52 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.099 0.476 . . . . 0.0 110.511 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -83.26 30.77 0.46 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -175.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.568 HH11 ' HA ' ' A' ' 69' ' ' ASP . 4.2 ptm180 -159.14 143.93 11.51 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 122.328 -0.232 . . . . 0.0 111.274 -177.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.548 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 13.9 Cg_endo -57.38 119.14 6.21 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.603 2.202 . . . . 0.0 112.945 177.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 tp -72.49 148.6 44.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.779 -174.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.495 HD23 ' HG3' ' A' ' 21' ' ' ARG . 42.9 mt -96.67 146.81 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 122.102 -0.374 . . . . 0.0 110.529 177.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.434 HG21 ' HA ' ' A' ' 17' ' ' LYS . 78.0 t -64.04 -39.74 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 O-C-N 122.05 -0.406 . . . . 0.0 111.427 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 t -72.17 -7.59 50.04 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.087 0.47 . . . . 0.0 111.1 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 26.6 tt0 -97.9 -7.3 30.51 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.408 0.623 . . . . 0.0 110.518 177.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.4 t -85.82 110.74 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.847 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.684 HG22 ' HD3' ' A' ' 95' ' ' ARG . 4.0 m -64.59 -67.91 0.4 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' A' ' 94' ' ' THR . 1.3 mpp_? -115.18 130.9 57.04 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 14.3 pt-20 -103.07 87.8 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.579 0.704 . . . . 0.0 109.641 169.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -85.23 140.2 31.06 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -171.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -83.58 157.37 22.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.134 0.492 . . . . 0.0 111.361 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.602 HD23 ' H ' ' A' ' 99' ' ' LEU . 2.7 pt? -85.64 119.29 25.81 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.498 0.666 . . . . 0.0 112.758 -176.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -114.18 94.36 4.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 166.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.587 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 65.5 mt -102.6 158.23 16.38 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.086 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -159.71 172.18 18.2 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.1 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.5 -82.91 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -117.59 8.67 12.93 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.113 0.482 . . . . 0.0 111.121 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 71.57 29.7 67.49 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.012 -174.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.847 ' H ' ' HD3' ' A' ' 107' ' ' PRO . 24.1 t -136.4 -22.1 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.453 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.847 ' HD3' ' H ' ' A' ' 106' ' ' VAL . 21.1 Cg_endo -90.25 50.2 1.03 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.697 1.598 . . . . 0.0 113.94 -163.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.621 ' NE2' ' HE ' ' A' ' 51' ' ' ARG . 0.4 OUTLIER -126.14 26.03 6.58 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -171.759 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.689 HD22 ' HB2' ' A' ' 43' ' ' GLN . 1.5 mp -100.65 -12.25 19.33 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.07 -9.17 46.55 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.389 177.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.23 -30.21 27.86 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.259 0.552 . . . . 0.0 111.198 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -100.56 -44.15 5.95 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.262 -172.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 53.5 mt . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 121.378 0.609 . . . . 0.0 111.051 -178.871 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.909 0.385 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.63 144.08 29.13 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.069 0.461 . . . . 0.0 111.701 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.558 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 5.2 mt -107.14 146.0 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.405 178.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 34.3 m-85 -134.97 138.71 44.28 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -176.227 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 67.2 tttt -151.18 122.65 7.89 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.982 0.42 . . . . 0.0 111.372 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.533 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -94.29 135.78 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.126 -178.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.467 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -150.23 167.45 26.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.89 0.376 . . . . 0.0 111.093 178.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 t -71.1 149.34 46.57 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.728 0.299 . . . . 0.0 111.301 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.05 -38.91 71.25 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.875 0.369 . . . . 0.0 110.918 177.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.3 77.54 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.025 0.44 . . . . 0.0 111.699 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -69.7 -40.28 76.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.149 0.5 . . . . 0.0 111.164 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.495 ' NE1' ' HE3' ' A' ' 17' ' ' LYS . 22.1 t-105 -73.23 -46.13 51.97 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.891 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.16 -41.21 92.31 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.827 0.346 . . . . 0.0 110.965 176.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.36 82.03 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.165 0.507 . . . . 0.0 110.846 174.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 13' ' ' TRP . . . -59.01 -47.55 84.78 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.147 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HE3' ' NE1' ' A' ' 13' ' ' TRP . 96.2 mttt -60.06 -37.81 80.96 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.306 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.87 90.7 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.848 0.356 . . . . 0.0 111.807 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.47 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 28.6 pt20 -94.92 -3.02 49.41 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.804 0.335 . . . . 0.0 111.812 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.67 6.96 60.38 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.505 -0.379 . . . . 0.0 113.293 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 68.6 mtt180 -143.8 157.44 44.37 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 122.505 -0.409 . . . . 0.0 111.408 -175.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 23' ' ' GLU . 46.7 t80 -134.83 178.84 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 170.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 87' ' ' PRO . 67.3 mm-40 92.45 156.12 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.246 1.019 . . . . 0.0 113.703 172.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.04 42.52 24.38 Favored Glycine 0 CA--C 1.526 0.751 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.548 -170.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.1 p -81.56 -176.63 6.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.713 0.292 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.55 -51.01 61.73 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.701 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 36.2 t -69.88 -51.17 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -54.72 -44.17 73.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.864 0.364 . . . . 0.0 111.669 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.13 -35.23 69.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.04 90.02 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.901 0.381 . . . . 0.0 111.408 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -69.84 -39.3 76.51 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.983 0.42 . . . . 0.0 111.07 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 129.41 -25.07 4.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.123 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -159.04 161.44 36.55 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.685 0.394 . . . . 0.0 110.663 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 23' ' ' GLU . 66.0 mt -61.82 140.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.143 0.497 . . . . 0.0 112.312 -173.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -139.32 105.97 5.36 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.053 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 3.8 mp -98.21 -175.41 3.11 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.515 175.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.5 m -131.97 155.37 48.09 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.22 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.31 173.23 12.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.657 174.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.92 -57.41 11.06 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.667 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.05 -42.79 99.8 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.122 0.486 . . . . 0.0 111.505 178.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -74.29 -15.1 60.98 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.914 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -70.85 -49.77 42.52 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.093 0.473 . . . . 0.0 110.686 176.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -61.5 -36.99 82.06 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.089 0.471 . . . . 0.0 110.639 174.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.1 -47.18 85.78 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.143 0.497 . . . . 0.0 110.873 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 92.7 m -61.55 -31.23 71.25 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.059 0.457 . . . . 0.0 110.811 175.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.59 -58.43 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.812 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.61 -30.56 55.08 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.982 0.42 . . . . 0.0 112.12 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -84.69 -49.24 8.68 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -116.55 -35.4 4.25 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 98.5 m-85 -114.06 59.08 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.612 0.72 . . . . 0.0 110.728 -176.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -72.0 -4.66 29.89 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.25 -0.886 . . . . 0.0 112.797 -174.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.57 -96.76 0.1 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.56 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.0 mt-30 59.79 -164.08 0.22 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.613 0.365 . . . . 0.0 111.651 -176.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.63 120.49 30.9 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.858 -0.526 . . . . 0.0 111.7 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 57.5 83.12 0.11 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.01 0.524 . . . . 0.0 112.185 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 53' ' ' GLN . 79.6 mt -99.09 123.55 43.46 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.576 177.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.423 ' O ' HD23 ' A' ' 8' ' ' LEU . 48.4 t -87.73 127.62 40.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HB2' HD11 ' A' ' 99' ' ' LEU . 67.4 tp -99.6 99.77 10.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.274 174.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 89.0 mt -75.61 107.72 7.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.751 177.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.558 ' HA ' ' O ' ' A' ' 4' ' ' ILE . . . -117.29 114.05 23.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.601 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 94' ' ' THR . 43.5 t -127.0 142.53 43.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.487 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 0.7 OUTLIER -69.86 133.81 47.78 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.456 175.261 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.6 30.54 0.24 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -174.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.32 -41.59 2.41 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 122.039 -0.413 . . . . 0.0 111.772 174.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' A' ' 62' ' ' GLU . 18.2 Cg_exo -70.27 39.21 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.591 2.194 . . . . 0.0 112.405 168.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 70' ' ' LEU . 48.8 tp -61.68 -41.93 98.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.565 0.746 . . . . 0.0 112.394 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 60.71 -114.87 7.02 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.171 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.9 10.61 0.47 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.365 0.602 . . . . 0.0 110.966 175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -102.16 -26.18 13.45 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.494 ' HB3' HD12 ' A' ' 66' ' ' LEU . 38.6 tp -70.5 96.77 1.21 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.438 0.637 . . . . 0.0 110.291 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.585 ' HG2' ' HB2' ' A' ' 73' ' ' GLU . 39.1 ttmt -103.26 102.29 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.68 -175.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 45.7 m95 -70.42 98.14 1.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.042 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 71' ' ' LYS . 9.7 tp10 -137.9 159.9 40.76 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.716 -169.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.37 179.15 4.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.071 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 88.5 p -134.6 -68.76 0.53 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.036 0.446 . . . . 0.0 111.346 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -106.42 -66.8 0.98 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.77 -107.2 0.63 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.295 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.61 -163.45 10.21 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.928 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 69.7 143.87 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.426 0.631 . . . . 0.0 112.43 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.42 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 79.8 mtt180 -100.27 117.79 35.21 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.056 0.455 . . . . 0.0 111.747 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -97.96 129.76 30.32 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.447 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.487 ' HB2' HD11 ' A' ' 70' ' ' LEU . 37.8 Cg_endo -66.83 103.93 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.117 1.878 . . . . 0.0 112.533 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' LEU . 74.6 m80 -96.51 154.29 17.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.078 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.0 mt -129.74 145.93 51.52 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 112.358 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -114.12 10.19 17.35 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.836 171.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.421 ' HA ' ' HE ' ' A' ' 86' ' ' ARG . 1.4 mmp_? -118.43 133.97 23.48 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.238 177.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 23' ' ' GLU . 14.2 Cg_exo -68.51 136.81 37.61 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 121.601 1.534 . . . . 0.0 111.583 173.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.94 101.48 6.87 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.292 0.568 . . . . 0.0 111.707 -171.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.96 120.13 11.39 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.309 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.409 HG11 ' HG2' ' A' ' 17' ' ' LYS . 80.2 t -53.38 -36.14 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.067 0.46 . . . . 0.0 111.565 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.3 t -60.07 -30.43 69.21 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -79.76 -20.23 46.8 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.832 0.349 . . . . 0.0 111.49 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.7 124.94 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 120.683 0.278 . . . . 0.0 111.668 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.469 HG23 HG13 ' A' ' 61' ' ' VAL . 82.6 p -77.18 -57.72 3.68 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 60' ' ' ALA . 6.7 ptp85 -131.54 145.41 51.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.144 0.497 . . . . 0.0 112.113 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.416 ' CD ' ' HE1' ' A' ' 13' ' ' TRP . 8.1 pt-20 -122.36 97.73 5.6 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.145 0.498 . . . . 0.0 111.037 176.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -82.75 118.49 23.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 111.648 -176.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -84.32 105.86 15.48 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.094 0.473 . . . . 0.0 110.486 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 58' ' ' LEU . 73.2 mt -82.85 103.35 12.26 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.188 0.518 . . . . 0.0 112.386 -173.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -91.6 142.01 28.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.194 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.61 127.21 32.58 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -176.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -134.73 167.79 20.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.631 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.63 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 173.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -100.49 3.91 43.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.643 0.259 . . . . 0.0 111.664 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.51 22.55 72.56 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.136 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.9 t -123.14 136.34 26.88 Favored Pre-proline 0 N--CA 1.471 0.588 0 C-N-CA 123.248 0.619 . . . . 0.0 110.256 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 53.1 Cg_exo -54.35 117.68 4.2 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.676 2.251 . . . . 0.0 113.761 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -75.39 98.24 3.83 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.8 mp -100.43 -40.63 7.38 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.988 -0.445 . . . . 0.0 111.76 173.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.03 -42.9 31.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.617 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -89.56 -29.34 18.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -66.44 -33.3 75.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 59.8 mt . . . . . 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.566 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.78 0.324 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.8 mt -111.59 130.0 55.89 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.627 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.501 HG13 HD22 ' A' ' 36' ' ' LEU . 16.8 pt -114.32 132.22 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-O 121.335 0.588 . . . . 0.0 110.935 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.797 ' HB3' HD21 ' A' ' 58' ' ' LEU . 32.3 m-85 -107.6 135.2 49.45 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.015 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.597 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 50.0 tttm -120.8 124.23 44.55 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 122.355 -0.215 . . . . 0.0 111.207 175.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.2 mp -93.23 136.91 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.505 HD21 ' HG ' ' A' ' 59' ' ' LEU . 2.2 pt? -153.87 174.01 15.15 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.023 0.44 . . . . 0.0 111.622 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -85.87 150.65 24.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.971 0.415 . . . . 0.0 111.41 175.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -34.14 70.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.01 0.433 . . . . 0.0 110.248 177.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.89 -39.55 85.71 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.444 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.48 ' OE1' ' HB2' ' A' ' 25' ' ' SER . 52.7 mt-10 -62.45 -53.32 56.54 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.341 0.591 . . . . 0.0 110.908 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.411 ' CH2' HG13 ' A' ' 90' ' ' VAL . 47.0 t-105 -60.91 -60.36 3.91 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.612 -174.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.548 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -61.18 -31.59 71.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.357 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -65.4 -59.16 4.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.011 0.434 . . . . 0.0 110.67 174.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.7 69.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.993 0.425 . . . . 0.0 111.808 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HA ' HG21 ' A' ' 90' ' ' VAL . 37.2 ttpt -71.21 -26.69 63.05 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.931 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.56 -30.62 52.73 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.819 172.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 7.7 mm-40 -78.97 -29.63 44.01 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.934 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.52 -2.48 65.01 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.157 -0.474 . . . . 0.0 113.214 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 10.3 ptm180 -148.21 125.24 11.36 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 122.404 -0.468 . . . . 0.0 111.925 -174.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.597 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 53.6 t80 -93.84 116.96 29.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.04 0.448 . . . . 0.0 110.505 176.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -109.96 9.96 24.32 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -174.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.95 175.6 20.93 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.844 -0.693 . . . . 0.0 114.551 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.48 ' HB2' ' OE1' ' A' ' 12' ' ' GLU . 38.8 t -128.52 -175.81 3.63 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.006 0.522 . . . . 0.0 110.889 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.46 -33.02 63.26 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.405 HG12 ' CE1' ' A' ' 35' ' ' HIS . 41.3 t -70.76 -45.91 71.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.418 0.627 . . . . 0.0 111.051 177.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.515 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 14.7 m-20 -62.6 -38.6 90.8 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.898 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.55 -21.92 60.23 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.648 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.5 -39.98 85.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.053 0.454 . . . . 0.0 110.877 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.46 -59.4 2.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.368 0.604 . . . . 0.0 110.734 171.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 154.71 -49.32 0.49 Allowed Glycine 0 CA--C 1.525 0.68 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.737 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -128.93 169.43 14.65 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.607 0.363 . . . . 0.0 110.852 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.0 mt -54.59 134.06 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.824 0.345 . . . . 0.0 111.274 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.515 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 25.5 p80 -143.3 123.61 13.82 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.212 0.53 . . . . 0.0 111.761 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 6' ' ' LYS . 5.0 mp -96.58 -163.06 1.01 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.676 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' HB2' ' A' ' 41' ' ' GLN . 81.9 p -137.76 150.09 46.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.837 0.351 . . . . 0.0 111.327 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -98.91 109.53 22.27 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -176.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.78 -103.78 0.26 Allowed Glycine 0 CA--C 1.53 1.002 0 N-CA-C 114.579 0.592 . . . . 0.0 114.579 173.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.06 -42.01 84.55 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.788 0.328 . . . . 0.0 111.642 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 53.0 mt-30 -53.21 -28.71 28.24 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.017 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.48 -56.56 13.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.486 178.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -61.43 -43.04 99.57 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.373 178.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 18.8 mm-40 -55.55 -57.0 13.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.943 177.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 84.6 m -57.3 -38.46 74.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.942 0.401 . . . . 0.0 111.363 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.15 83.38 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.966 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.86 -24.65 28.47 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 67.1 mttm -88.87 -59.01 2.34 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -97.18 -33.87 11.33 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -170.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -98.75 64.47 1.48 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.506 0.669 . . . . 0.0 110.853 -173.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.438 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 4.5 mmp_? -109.36 139.14 44.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.804 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.24 39.85 93.06 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 114.959 0.744 . . . . 0.0 114.959 174.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.558 ' HB2' HD21 ' A' ' 56' ' ' LEU . 51.1 mt-30 -116.14 142.74 46.42 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 117.351 0.576 . . . . 0.0 111.116 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.49 127.63 32.44 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 58.95 84.1 0.11 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.429 177.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 53' ' ' GLN . 85.6 mt -101.65 134.96 43.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.274 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.8 t -113.09 152.96 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 110.928 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 5' ' ' TYR . 3.2 tt -129.2 114.88 16.85 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.008 0.433 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' HD21 ' A' ' 8' ' ' LEU . 86.5 mt -90.83 107.22 19.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.996 0.426 . . . . 0.0 110.873 177.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.523 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -95.87 107.37 19.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.505 177.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.23 143.91 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.014 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -72.27 127.97 34.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 122.096 -0.377 . . . . 0.0 110.604 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.15 -47.91 71.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.037 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 63.38 161.86 0.12 Allowed Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.79 -62.15 0.23 Allowed 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.485 2.123 . . . . 0.0 112.963 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 19.0 66.03 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -44.46 130.95 7.38 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 115.067 -0.969 . . . . 0.0 114.918 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 78.66 -24.67 0.21 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -69.0 -42.29 76.67 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.648 -0.657 . . . . 0.0 111.053 172.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.99 143.3 32.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 111.01 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -153.61 132.08 12.11 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.809 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 80' ' ' ARG . 93.0 m95 -77.84 64.05 3.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.701 0.762 . . . . 0.0 110.55 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -80.03 132.56 36.02 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.644 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -147.23 165.8 28.96 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.122 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 55.7 m -122.42 -178.08 3.8 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.779 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 75.18 -47.37 0.61 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 165.43 -34.42 0.25 Allowed Glycine 0 CA--C 1.524 0.624 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.689 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.22 -149.08 5.35 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.294 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 64.03 -175.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.124 0.488 . . . . 0.0 111.951 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.414 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 38.4 ptt180 -160.07 135.74 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.783 0.325 . . . . 0.0 111.369 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -131.21 123.21 19.57 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.64 95.06 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 121.942 1.761 . . . . 0.0 112.637 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -88.36 123.12 32.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.19 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -101.35 112.56 25.12 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.273 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -82.15 8.25 11.41 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -174.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -111.36 148.64 39.21 Favored Pre-proline 0 N--CA 1.473 0.689 0 O-C-N 122.034 -0.416 . . . . 0.0 110.904 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.66 109.47 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.022 1.815 . . . . 0.0 110.975 171.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.43 104.69 1.29 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.303 0.573 . . . . 0.0 110.825 -171.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.21 137.27 50.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.107 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.599 HG21 ' HA ' ' A' ' 17' ' ' LYS . 68.0 t -57.68 -34.73 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.8 m -69.46 -9.24 52.83 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.835 -0.621 . . . . 0.0 112.183 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -105.91 -6.99 18.44 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.926 0.393 . . . . 0.0 111.826 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 59' ' ' LEU . 58.7 t -69.74 110.46 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 122.024 -0.422 . . . . 0.0 111.233 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 85.1 m -48.81 -58.52 4.68 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -147.78 138.42 23.18 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.358 0.599 . . . . 0.0 112.104 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.89 118.88 35.46 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.442 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.97 108.45 12.95 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 122.025 -0.422 . . . . 0.0 111.969 -178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.0 126.59 31.23 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.234 0.54 . . . . 0.0 110.866 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -83.87 111.1 18.92 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -74.85 -11.72 60.21 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 177.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.3 mt 65.64 -167.43 0.21 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.693 0.397 . . . . 0.0 111.261 -176.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -149.05 -172.85 4.22 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 122.289 -0.257 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -28.49 65.42 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.68 -3.63 58.74 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.148 0.499 . . . . 0.0 110.649 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.11 -6.83 61.79 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 116.057 -0.519 . . . . 0.0 112.989 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.98 133.34 39.41 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.669 -0.312 . . . . 0.0 111.344 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.96 118.63 5.66 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.158 1.905 . . . . 0.0 112.354 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -66.3 97.99 0.44 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.34 0.59 . . . . 0.0 112.186 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.1 mp -100.17 -15.78 18.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.948 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -53.84 -33.39 49.61 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.759 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -68.54 -37.04 79.62 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 122.799 0.44 . . . . 0.0 111.652 174.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -85.45 -30.17 23.73 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -173.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 40.0 mt . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -176.272 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 63' ' ' ALA . 14.0 m . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 62' ' ' GLU . 0.4 OUTLIER -128.46 132.0 48.39 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.931 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.605 HD12 HD22 ' A' ' 36' ' ' LEU . 14.1 pt -114.16 145.76 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.542 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.9 m-85 -123.81 146.5 48.31 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.726 -176.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.54 ' HD3' ' HG ' ' A' ' 36' ' ' LEU . 6.4 ttpm? -156.35 125.28 5.99 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.252 -0.28 . . . . 0.0 111.433 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 55.6 mt -94.91 135.94 27.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 120.797 0.332 . . . . 0.0 111.808 -178.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.417 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -143.79 172.03 13.4 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.624 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.6 m -76.0 142.57 41.85 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.852 0.358 . . . . 0.0 111.587 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -55.94 -44.17 78.12 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.56 80.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.15 0.5 . . . . 0.0 112.127 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -69.42 -43.25 73.76 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.039 0.447 . . . . 0.0 110.95 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.6 t-105 -66.54 -34.75 78.6 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.628 177.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 24.4 t70 -60.04 -52.08 66.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.338 0.589 . . . . 0.0 110.432 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -55.32 -39.99 70.62 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.105 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 22' ' ' PHE . . . -59.82 -45.77 91.31 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.397 175.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.55 ' HA ' HG21 ' A' ' 90' ' ' VAL . 10.5 mtmp? -61.0 -36.0 78.33 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.859 0.361 . . . . 0.0 111.054 176.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -42.41 98.99 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.136 0.494 . . . . 0.0 111.129 174.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 77.0 mm-40 -70.74 -26.61 63.45 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.223 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.5 -1.51 61.1 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.406 -0.426 . . . . 0.0 112.405 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -150.77 134.57 16.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.099 0.56 . . . . 0.0 110.346 -173.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' ' HB1' ' A' ' 16' ' ' ALA . 90.1 t80 -134.9 130.25 35.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.85 0.357 . . . . 0.0 111.55 -176.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.677 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 1.7 pm0 -100.69 -75.19 0.59 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.294 175.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.677 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . -157.88 -123.62 0.75 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.717 -176.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.44 ' H ' ' HB3' ' A' ' 28' ' ' ASP . 23.2 t -175.69 -164.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.583 -0.363 . . . . 0.0 111.1 -173.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.89 -63.29 1.23 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' A' ' 30' ' ' ALA . 7.6 p -55.8 -40.33 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-O 121.119 0.485 . . . . 0.0 111.509 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -57.04 -54.68 44.02 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.426 177.274 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.09 -13.4 61.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' VAL . . . -66.04 -54.66 23.09 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.753 0.311 . . . . 0.0 110.614 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.42 -42.19 25.99 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.655 0.264 . . . . 0.0 111.229 174.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.42 13.42 7.51 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 170.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -148.41 139.27 23.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.852 0.826 . . . . 0.0 112.292 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mt -65.02 87.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.481 0.658 . . . . 0.0 111.157 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -93.29 112.07 23.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.605 HD22 HD12 ' A' ' 4' ' ' ILE . 4.8 mp -94.71 -160.65 0.79 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.667 176.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.5 p -142.88 153.03 42.73 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.867 0.365 . . . . 0.0 111.0 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.22 178.82 5.49 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.851 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.65 -67.56 2.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.035 -0.603 . . . . 0.0 113.653 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 3.3 mp0 -56.08 -42.77 77.22 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 122.642 -0.328 . . . . 0.0 111.12 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.503 ' NE2' ' HB1' ' A' ' 79' ' ' ALA . 82.8 mt-30 -56.56 -44.06 80.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.834 0.35 . . . . 0.0 111.428 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.41 95.96 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.995 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.602 ' HB2' HD11 ' A' ' 109' ' ' LEU . 34.2 tt0 -64.1 -37.98 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.605 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.8 mt-10 -62.51 -51.77 66.12 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.877 0.37 . . . . 0.0 110.956 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 63.9 m -60.84 -35.27 76.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.027 0.442 . . . . 0.0 110.886 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.526 ' HB1' ' HG3' ' A' ' 107' ' ' PRO . . . -67.85 -48.82 65.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.743 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.7 -14.82 55.68 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.073 0.463 . . . . 0.0 111.606 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -98.98 -63.05 1.16 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.412 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -84.9 -49.06 8.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.165 0.507 . . . . 0.0 112.136 -176.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -97.42 56.1 1.31 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.961 0.41 . . . . 0.0 111.469 -173.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.85 -33.95 38.52 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 170.77 44.99 0.03 OUTLIER Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.11 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.553 ' HB2' HD21 ' A' ' 56' ' ' LEU . 85.2 mt-30 -79.06 133.47 36.79 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.896 0.379 . . . . 0.0 111.713 -174.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.93 61.41 5.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.131 0.491 . . . . 0.0 112.154 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -171.79 29.9 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.439 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 53' ' ' GLN . 22.3 mt -106.56 141.77 37.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 88.1 t -125.88 117.55 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.548 174.158 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.542 HD11 ' HB3' ' A' ' 5' ' ' TYR . 66.0 tp -93.14 100.08 12.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.707 178.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.6 mt -75.81 109.35 9.35 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.719 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -99.57 112.04 24.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 175.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.1 t -120.72 138.33 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 121.008 0.433 . . . . 0.0 112.148 -175.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.491 ' HA ' HD22 ' A' ' 3' ' ' LEU . 9.0 pt-20 -69.23 108.4 3.63 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.722 0.772 . . . . 0.0 110.281 175.096 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.521 ' HB3' HG22 ' A' ' 2' ' ' THR . . . -85.69 1.56 48.9 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -169.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.55 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 39.8 mt-10 -80.76 -49.94 1.06 Allowed Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 76.0 Cg_exo -52.5 -48.63 20.9 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 122.336 2.024 . . . . 0.0 113.06 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 pp -92.79 10.79 29.4 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -57.78 -28.29 60.16 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 114.652 0.621 . . . . 0.0 114.652 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -66.31 -26.44 67.31 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.361 0.581 . . . . 0.0 111.533 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.37 11.84 30.48 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.259 177.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 82' ' ' PRO . 42.0 tp -113.69 102.97 10.76 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.36 107.32 19.07 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 59.9 m95 -69.39 84.57 0.4 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.793 0.806 . . . . 0.0 109.489 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -119.85 120.49 36.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.287 -167.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.12 89.26 1.14 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.02 0.438 . . . . 0.0 111.409 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.5 p -75.2 78.89 2.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.685 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 63.37 178.52 0.16 Allowed 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.498 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.65 -66.93 2.66 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.97 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.58 -19.84 2.03 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.794 -178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.503 ' HB1' ' NE2' ' A' ' 41' ' ' GLN . . . -83.84 129.18 34.94 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.209 0.528 . . . . 0.0 112.006 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.3 mtp85 -70.85 104.35 2.89 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.478 176.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -94.4 123.27 59.09 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 120.802 0.334 . . . . 0.0 111.419 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 70' ' ' LEU . 40.9 Cg_endo -67.42 109.15 1.74 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.531 2.154 . . . . 0.0 112.385 177.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -100.02 106.51 18.28 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.476 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.8 tp -93.5 138.67 31.56 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.97 0.414 . . . . 0.0 111.123 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.93 29.81 7.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.476 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 28.7 mmt180 -138.11 141.15 31.15 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 122.538 0.335 . . . . 0.0 111.711 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 23.2 Cg_exo -64.97 120.36 7.58 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.769 2.312 . . . . 0.0 112.298 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 62.7 tp -81.23 110.86 17.1 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.063 0.459 . . . . 0.0 111.527 -177.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.28 136.26 53.22 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.215 -0.303 . . . . 0.0 110.448 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 17' ' ' LYS . 91.4 t -58.37 -41.17 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.247 0.546 . . . . 0.0 110.935 178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.2 t -70.94 -10.08 59.03 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.828 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -95.73 -15.0 22.91 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.975 0.417 . . . . 0.0 111.333 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.25 145.0 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.968 0.413 . . . . 0.0 111.285 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 31.1 m -80.26 -50.77 9.76 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.909 0.385 . . . . 0.0 111.298 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.418 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 9.7 tpp180 -150.14 143.95 25.38 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.271 0.558 . . . . 0.0 111.788 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 9.1 pt-20 -116.41 98.76 6.75 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.081 173.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -89.09 87.36 7.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.165 0.507 . . . . 0.0 111.72 -176.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -67.95 103.93 1.6 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.333 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.3 tp 60.11 101.64 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.026 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 13.8 t70 -119.51 89.86 3.21 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.043 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.49 164.04 22.79 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 0.0 112.094 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.895 ' HB2' ' HB2' ' A' ' 108' ' ' GLN . 5.9 t70 -111.74 -169.41 1.46 Allowed 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.019 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.14 -25.75 61.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -89.41 0.93 56.49 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 75.96 5.56 80.36 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.69 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.4 t -89.45 135.8 30.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 122.32 0.248 . . . . 0.0 110.509 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.526 ' HG3' ' HB1' ' A' ' 46' ' ' ALA . 20.4 Cg_endo -59.44 95.95 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.289 1.993 . . . . 0.0 111.586 175.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.895 ' HB2' ' HB2' ' A' ' 102' ' ' ASP . 2.6 tp-100 -83.83 44.53 1.0 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.732 0.777 . . . . 0.0 110.699 -174.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.602 HD11 ' HB2' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.12 5.82 0.32 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.145 -0.934 . . . . 0.0 113.186 -176.902 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.95 -34.95 31.46 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.688 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -65.08 -27.63 68.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.034 0.445 . . . . 0.0 111.281 174.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -80.26 -24.2 40.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 120.973 0.416 . . . . 0.0 110.745 173.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.5 mt . . . . . 0 N--CA 1.47 0.572 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.77 -176.195 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.37 99.43 4.13 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.948 0.404 . . . . 0.0 111.714 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.588 HD12 HD13 ' A' ' 36' ' ' LEU . 15.4 pt -104.86 142.66 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 110.69 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -125.19 152.22 44.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.225 0.536 . . . . 0.0 112.098 -172.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HZ1' ' CG ' ' A' ' 28' ' ' ASP . 62.6 tttp -147.54 106.66 3.86 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.613 175.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -91.51 137.62 21.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.229 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.18 172.62 17.29 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.001 0.429 . . . . 0.0 111.268 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 94.4 p -76.24 146.4 39.05 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.054 0.454 . . . . 0.0 111.43 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -41.92 62.07 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.555 -179.344 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.46 -51.07 71.46 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.81 -29.48 69.96 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.028 0.442 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -70.23 -44.69 68.04 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.143 175.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -33.38 72.93 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.221 -0.3 . . . . 0.0 111.114 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.53 -40.96 88.9 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.853 175.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.58 79.52 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.379 174.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -58.6 -37.19 75.29 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.066 0.46 . . . . 0.0 111.211 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.73 -52.77 61.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.687 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 11.5 pt20 -77.24 -10.47 59.44 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 81.41 -45.14 3.18 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-O 121.354 0.419 . . . . 0.0 112.678 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.41 ' HG2' HD23 ' A' ' 89' ' ' LEU . 48.0 mtm180 -94.17 -173.93 3.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.451 0.643 . . . . 0.0 111.208 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -141.23 94.68 2.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.581 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -72.42 -20.91 61.34 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.91 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.85 152.89 6.67 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.043 -0.526 . . . . 0.0 113.073 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 86.2 p -91.12 -171.66 3.05 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.97 -53.57 15.63 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 64.0 t -59.88 -53.75 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.517 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 12.9 m-20 -57.96 -47.5 82.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.237 0.541 . . . . 0.0 111.713 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.89 -16.81 62.71 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.697 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -55.66 7.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -79.03 -51.59 9.38 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.44 -34.23 0.59 Allowed Glycine 0 CA--C 1.529 0.926 0 C-N-CA 120.298 -0.953 . . . . 0.0 114.561 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -131.1 157.08 44.07 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 117.455 0.627 . . . . 0.0 111.94 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.759 HD12 HD13 ' A' ' 88' ' ' LEU . 66.9 mt -70.58 114.83 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.577 0.703 . . . . 0.0 111.989 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -81.43 124.62 29.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.845 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 HD12 ' A' ' 4' ' ' ILE . 81.6 mt -109.82 111.31 22.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.702 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -77.85 105.85 9.31 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.288 0.566 . . . . 0.0 111.917 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.91 101.92 3.94 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.95 -95.99 0.01 OUTLIER Glycine 0 CA--C 1.532 1.098 0 N-CA-C 114.706 0.643 . . . . 0.0 114.706 173.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.39 -43.48 61.93 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.287 0.565 . . . . 0.0 111.366 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -63.13 -37.08 85.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.173 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -61.08 -44.66 97.03 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.628 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -67.0 -36.9 83.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.26 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.38 -56.7 17.4 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.912 0.386 . . . . 0.0 110.805 175.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.9 m -57.59 -38.56 75.07 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 111.377 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.87 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -68.34 -39.14 82.02 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.68 -19.25 60.34 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 111.712 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -93.2 -57.88 2.48 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.102 0.477 . . . . 0.0 111.565 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.71 -55.72 3.84 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -92.29 17.75 9.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -171.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -64.97 113.76 4.09 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.934 0.397 . . . . 0.0 111.428 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.77 25.96 73.96 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 114.237 0.455 . . . . 0.0 114.237 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -99.97 163.46 12.43 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 117.352 0.576 . . . . 0.0 111.451 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -109.21 174.18 5.98 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.862 -179.232 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 62.52 26.01 15.47 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.841 0.456 . . . . 0.0 112.029 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -88.47 111.48 21.86 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.75 135.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 121.006 0.431 . . . . 0.0 110.455 174.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.411 HD23 ' O ' ' A' ' 58' ' ' LEU . 7.4 tt -102.25 106.23 17.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.037 0.446 . . . . 0.0 110.465 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.496 HD22 HG21 ' A' ' 93' ' ' VAL . 61.3 mt -84.97 107.29 17.03 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.691 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.514 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -102.96 117.86 35.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.743 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 4' ' ' ILE . 53.4 t -117.57 116.24 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.518 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.62 95.77 0.89 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -42.53 -65.65 0.45 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -170.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 64.75 158.35 0.12 Allowed Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 120.789 0.328 . . . . 0.0 110.976 -173.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 57.36 3.4 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.234 1.956 . . . . 0.0 112.809 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.603 HD12 ' N ' ' A' ' 67' ' ' GLY . 1.6 pp -67.32 -28.88 68.35 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.603 ' N ' HD12 ' A' ' 66' ' ' LEU . . . 176.35 154.08 11.31 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.741 -179.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.51 -23.89 67.58 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.118 0.485 . . . . 0.0 111.438 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -65.71 -9.54 28.76 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.107 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.577 ' HB2' HD13 ' A' ' 84' ' ' LEU . 57.8 tp -98.54 100.89 12.17 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 168.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -116.36 133.47 55.99 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.094 0.473 . . . . 0.0 112.067 -176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -73.97 91.51 2.03 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.33 0.586 . . . . 0.0 110.259 172.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.31 143.08 35.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.173 -174.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -115.2 91.85 3.74 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 174.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.3 m -69.7 168.39 15.03 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.859 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.0 tpp85 -58.19 95.64 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.089 0.471 . . . . 0.0 111.354 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.87 -73.25 0.26 Allowed Glycine 0 CA--C 1.527 0.81 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.227 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 168.3 -158.26 30.89 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.364 -0.446 . . . . 0.0 113.015 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 62.29 -173.22 0.15 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -126.69 128.03 46.06 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.733 178.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -121.64 94.72 48.36 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.576 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.14 103.18 0.73 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.018 1.812 . . . . 0.0 112.226 178.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -101.41 115.52 30.7 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.336 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.577 HD13 ' HB2' ' A' ' 70' ' ' LEU . 30.2 tp -96.32 108.21 20.68 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.05 0.452 . . . . 0.0 109.938 175.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -81.0 55.32 2.44 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 120.891 0.377 . . . . 0.0 111.585 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -141.12 161.44 53.4 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.17 103.64 1.45 Allowed 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.532 2.155 . . . . 0.0 110.963 163.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.759 HD13 HD12 ' A' ' 34' ' ' ILE . 10.0 mp -75.71 122.86 24.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -169.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.41 HD23 ' HG2' ' A' ' 21' ' ' ARG . 33.1 mt -71.94 106.73 4.35 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.832 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 90' ' ' VAL . 42.3 t 54.14 39.1 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-O 122.2 1.0 . . . . 0.0 109.408 -171.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.753 ' HB2' HG23 ' A' ' 93' ' ' VAL . 70.9 m 56.5 19.85 4.44 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.36 -174.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 46.17 36.17 3.03 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.069 0.938 . . . . 0.0 110.813 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.753 HG23 ' HB2' ' A' ' 91' ' ' SER . 10.7 t -68.07 104.16 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.833 -176.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 70.0 m -74.73 -49.63 20.38 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.37 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 13.0 ttm180 -115.52 138.95 50.51 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.302 0.572 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -132.0 123.5 27.44 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.12 -176.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -147.31 146.75 29.82 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.47 131.81 39.25 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.213 174.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 107' ' ' PRO . 53.9 tp -63.97 128.2 34.77 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -173.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -91.96 112.39 24.3 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.679 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.8 mt -94.75 160.61 14.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.625 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -102.91 -171.44 1.95 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 111.605 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.01 15.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -111.55 -13.18 13.86 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.46 14.06 36.47 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.656 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.57 124.72 43.37 Favored Pre-proline 0 CA--C 1.541 0.625 0 O-C-N 122.647 -0.326 . . . . 0.0 111.279 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.87 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 53.0 Cg_exo -55.71 114.85 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.862 2.374 . . . . 0.0 113.177 177.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -75.61 84.9 2.65 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.347 0.594 . . . . 0.0 112.163 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 42' ' ' ALA . 4.3 mp -81.7 -11.55 59.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.52 174.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -54.79 -33.15 55.58 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.822 176.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.93 -27.73 63.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.15 0.5 . . . . 0.0 110.935 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -79.16 -44.86 21.09 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.235 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.541 0.6 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.595 -175.801 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.8 p . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 120.894 0.378 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.07 134.58 38.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.85 0.357 . . . . 0.0 111.675 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.482 HG23 ' HB2' ' A' ' 63' ' ' ALA . 22.5 pt -116.39 143.65 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.811 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 58.1 m-85 -126.24 135.63 51.82 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.965 0.412 . . . . 0.0 112.061 -175.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -134.44 115.01 13.49 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.373 173.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.8 mt -90.56 131.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.735 0.302 . . . . 0.0 110.778 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.437 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.9 pt? -147.61 161.2 41.63 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.034 0.445 . . . . 0.0 111.465 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.7 p -69.92 155.66 40.24 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.17 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HB2' ' HB3' ' A' ' 55' ' ' ASN . 38.9 tpt85 -55.61 -33.3 63.85 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.93 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.81 -56.24 21.51 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.904 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -52.88 -47.58 67.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.244 0.545 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -70.43 -41.35 73.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.313 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.99 -52.67 58.51 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 110.735 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.62 -50.76 64.97 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.007 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 22' ' ' PHE . . . -58.46 -43.24 88.79 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.527 177.059 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -61.56 -39.66 91.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.936 0.398 . . . . 0.0 111.257 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.96 -33.59 65.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 176.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -74.97 -24.23 58.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.514 176.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.56 -10.43 61.91 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.523 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -159.08 141.51 13.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.519 . . . . 0.0 112.403 -178.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.564 ' CZ ' HD22 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -120.32 116.09 24.85 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.402 0.62 . . . . 0.0 111.573 173.411 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 87' ' ' PRO . 10.1 pt-20 -76.64 2.47 14.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.891 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 129.32 166.39 11.9 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.881 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 51.3 m -75.97 176.5 7.84 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.732 -0.275 . . . . 0.0 110.744 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.6 -52.66 63.03 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.035 0.445 . . . . 0.0 111.223 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.52 -50.21 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.286 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 2.4 m-20 -52.46 -60.53 3.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.95 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.49 -28.15 66.78 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.218 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.45 -46.25 70.32 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -88.45 -32.21 18.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.92 -66.25 0.31 Allowed Glycine 0 CA--C 1.526 0.773 0 C-N-CA 120.17 -1.014 . . . . 0.0 114.513 174.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -111.66 162.44 15.19 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.383 0.611 . . . . 0.0 112.256 -172.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.579 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 61.3 mt -66.78 136.27 27.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.606 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -92.14 120.17 32.48 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.012 0.435 . . . . 0.0 111.794 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.71 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 67.1 mt -116.83 169.16 9.6 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.183 175.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.0 m -139.56 154.96 47.75 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.081 0.467 . . . . 0.0 111.712 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.23 113.61 25.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.483 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.3 -107.09 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 114.343 0.497 . . . . 0.0 114.343 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -50.02 -47.08 53.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.043 0.537 . . . . 0.0 112.439 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -57.25 -25.63 59.47 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.34 -49.07 46.12 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 111.002 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.589 ' HB2' HD11 ' A' ' 109' ' ' LEU . 55.8 tt0 -65.85 -36.76 84.35 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.021 0.439 . . . . 0.0 110.856 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.98 -52.61 64.27 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.064 174.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.5 m -57.84 -33.33 68.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.807 0.336 . . . . 0.0 111.128 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.03 -54.48 45.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.902 0.382 . . . . 0.0 110.87 174.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.17 -30.32 69.26 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.024 0.44 . . . . 0.0 111.978 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -76.81 -46.79 23.61 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -110.36 -57.56 2.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.406 0.622 . . . . 0.0 112.385 -174.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.57 ' HB3' HD13 ' A' ' 56' ' ' LEU . 74.6 m-85 -95.2 60.65 2.34 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.423 0.63 . . . . 0.0 111.275 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -73.05 -34.54 66.35 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -174.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 176.91 65.88 0.06 OUTLIER Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.528 -0.844 . . . . 0.0 113.815 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.57 24.63 10.82 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.54 -0.388 . . . . 0.0 111.815 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 55.48 120.85 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 10' ' ' ARG . 88.0 m-20 64.74 89.44 0.09 Allowed 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.678 0.752 . . . . 0.0 111.809 -176.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 50' ' ' PHE . 58.5 mt -121.24 111.35 17.27 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.779 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.407 ' O ' HD23 ' A' ' 8' ' ' LEU . 55.4 t -84.99 128.88 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.329 0.585 . . . . 0.0 112.475 -171.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.519 ' HB2' HD11 ' A' ' 99' ' ' LEU . 66.5 tp -97.06 115.1 26.88 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.239 172.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 83.8 mt -88.89 107.74 19.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 0.0 110.971 176.053 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.14 100.67 10.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.596 178.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.494 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 48.3 t -114.69 132.35 64.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.722 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.9 92.43 1.26 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 171.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.482 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -45.06 -66.78 0.35 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -163.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.8 mm-40 68.69 157.43 0.15 Allowed Pre-proline 0 N--CA 1.473 0.682 0 CA-C-O 121.094 0.473 . . . . 0.0 111.129 -168.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -59.06 -41.34 62.03 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.929 1.752 . . . . 0.0 112.194 171.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.3 mt 70.81 -53.12 0.67 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.946 0.898 . . . . 0.0 111.002 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.17 -77.61 0.05 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.83 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -141.93 7.19 1.83 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 123.16 0.584 . . . . 0.0 110.695 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.546 ' OD2' ' HG3' ' A' ' 86' ' ' ARG . 4.7 m-20 -67.95 -52.1 39.91 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -164.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.8 tp -69.27 97.92 0.99 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.712 0.768 . . . . 0.0 111.419 -170.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -99.23 105.15 17.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.222 -177.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -75.06 101.67 4.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.201 0.524 . . . . 0.0 110.639 176.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.97 102.44 2.41 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.608 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -108.24 86.09 2.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.063 0.459 . . . . 0.0 110.808 175.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -110.54 -150.96 0.47 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.058 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.4 mtm180 -67.54 79.34 0.17 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.308 0.575 . . . . 0.0 110.854 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.47 160.23 22.23 Favored Glycine 0 CA--C 1.525 0.694 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.711 -178.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.87 -34.33 21.92 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.699 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -83.37 132.5 34.99 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 122.433 -0.451 . . . . 0.0 112.055 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -89.42 116.59 27.72 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.828 0.347 . . . . 0.0 110.773 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -98.99 112.33 62.72 Favored Pre-proline 0 N--CA 1.472 0.666 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.71 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 17.6 Cg_exo -66.41 135.5 39.77 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.528 2.152 . . . . 0.0 113.404 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -121.44 154.45 36.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.475 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.579 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 23.8 tp -123.09 140.81 52.64 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.568 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -82.17 -62.46 1.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.546 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 13.0 mtm-85 -71.87 155.76 91.73 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -174.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HA ' ' HA ' ' A' ' 23' ' ' GLU . 51.9 Cg_exo -56.76 115.8 2.74 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.313 2.009 . . . . 0.0 111.516 168.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' A' ' 22' ' ' PHE . 2.5 tt -64.83 116.6 6.49 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 111.715 -171.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.1 mt -78.64 128.96 34.19 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.049 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.52 -33.76 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-O 120.764 0.316 . . . . 0.0 111.483 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 63.7 p -65.46 -28.09 68.97 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.847 0.356 . . . . 0.0 111.603 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.57 -20.11 58.84 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.03 119.42 17.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.949 175.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.494 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 57.0 p -74.93 -63.7 1.2 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -120.45 142.86 48.86 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.613 0.72 . . . . 0.0 112.914 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -132.55 148.59 52.38 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.32 176.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.53 138.79 15.68 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -84.14 127.57 34.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.89 0.376 . . . . 0.0 110.389 177.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 58' ' ' LEU . 94.6 mt -91.62 119.26 31.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.122 0.487 . . . . 0.0 112.223 -176.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.58 154.5 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.02 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -150.07 149.81 30.84 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.201 0.525 . . . . 0.0 112.183 -176.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -100.48 -172.53 2.22 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.631 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.4 7.84 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.04 -10.74 52.3 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.242 0.544 . . . . 0.0 110.204 177.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.5 36.6 58.88 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.79 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 72.5 t -139.44 116.96 8.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.439 ' HA ' ' HB3' ' A' ' 101' ' ' LEU . 36.5 Cg_endo -66.52 98.85 0.41 Allowed 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 121.951 1.767 . . . . 0.0 110.681 167.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -74.84 84.35 2.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.6 0.714 . . . . 0.0 112.44 -169.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.589 HD11 ' HB2' ' A' ' 43' ' ' GLN . 2.2 pp -96.08 5.68 50.57 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.821 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.55 -24.44 56.53 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.436 -0.412 . . . . 0.0 113.639 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -77.56 -11.39 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.147 0.499 . . . . 0.0 111.353 174.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -98.98 -47.64 5.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.179 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 CA--C 1.539 0.556 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -176.805 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.0 p . . . . . 0 N--CA 1.468 0.45 0 CA-C-O 120.894 0.378 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.1 mt -112.96 130.95 55.94 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.962 0.41 . . . . 0.0 111.66 -177.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 70' ' ' LEU . 24.0 pt -105.01 146.17 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.723 174.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.453 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 44.1 m-85 -129.85 164.23 24.58 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.247 0.546 . . . . 0.0 112.148 -172.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE2' ' HG ' ' A' ' 36' ' ' LEU . 24.5 ttmm -156.52 106.76 2.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.809 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.1 mt -88.89 135.9 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.945 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.448 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.0 pt? -152.24 166.93 30.23 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.952 0.406 . . . . 0.0 111.305 -177.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 t -75.68 150.48 37.9 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.858 0.361 . . . . 0.0 111.096 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.545 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . 8.7 tpt180 -56.82 -35.67 69.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.043 0.449 . . . . 0.0 110.839 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.71 -37.47 73.57 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.373 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -75.88 -38.84 57.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.122 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -69.15 -48.43 62.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.33 -37.67 84.13 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.207 -0.308 . . . . 0.0 111.587 175.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.47 -45.29 92.05 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.064 0.459 . . . . 0.0 110.648 174.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.7 -53.02 62.94 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.563 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -61.84 -27.57 68.87 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.887 0.375 . . . . 0.0 111.66 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.63 -51.36 51.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.957 0.408 . . . . 0.0 111.403 176.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 12.6 pt20 -87.88 3.27 49.08 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.85 -1.01 48.79 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.502 -0.38 . . . . 0.0 114.034 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -149.14 149.21 30.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 122.406 -0.467 . . . . 0.0 111.513 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -110.42 132.87 53.8 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.46 0.648 . . . . 0.0 111.872 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -106.61 130.57 54.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.087 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -47.75 -71.28 0.58 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.52 0.568 . . . . 0.0 114.52 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 44.3 t 179.4 159.34 0.68 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.713 0.405 . . . . 0.0 110.143 -178.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -55.19 35.45 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.3 p -63.15 -33.32 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 111.813 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.576 ' HB2' ' HB3' ' A' ' 25' ' ' SER . 22.1 t0 -62.1 -58.44 7.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.251 0.548 . . . . 0.0 110.481 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.97 -33.83 76.61 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.04 -37.95 89.31 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -75.99 -34.57 59.75 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.755 0.312 . . . . 0.0 110.771 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 165.12 -68.86 0.2 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 120.151 -1.023 . . . . 0.0 114.566 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.576 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 52.9 m-85 -145.45 141.84 28.73 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 122.42 -0.459 . . . . 0.0 111.738 -167.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 62.1 mt -50.96 107.09 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -174.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -80.53 127.93 33.01 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.281 0.562 . . . . 0.0 111.474 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HG ' ' HE2' ' A' ' 6' ' ' LYS . 7.3 mp -91.32 -46.33 8.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.5 m 66.5 97.06 0.05 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.158 0.504 . . . . 0.0 110.973 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.52 155.92 19.1 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.74 -119.92 18.92 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.721 -0.672 . . . . 0.0 113.939 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.404 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.7 mp0 -59.74 -40.0 86.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.118 0.485 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -67.39 -29.13 68.56 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.141 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.19 -50.87 59.39 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.138 0.494 . . . . 0.0 110.895 176.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -57.41 -47.52 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.251 175.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.539 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 33.1 tt0 -61.35 -48.36 81.64 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.302 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -60.82 -37.86 83.43 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 120.952 0.405 . . . . 0.0 111.162 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.413 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.43 -40.84 83.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.74 175.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.12 -25.62 61.8 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.024 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.539 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 65.1 mttm -74.78 -69.43 0.46 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.39 0.614 . . . . 0.0 111.669 177.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.3 m0 -75.0 -60.68 2.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.503 -0.771 . . . . 0.0 112.4 -170.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -82.92 -66.33 0.9 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.575 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 70.81 -65.54 0.33 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -151.48 56.19 0.45 Allowed Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.57 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.627 ' HB2' HD21 ' A' ' 56' ' ' LEU . 26.0 mt-30 -99.81 -164.66 1.14 Allowed 'General case' 0 CA--C 1.539 0.544 0 O-C-N 122.774 -0.251 . . . . 0.0 110.834 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.67 -67.19 0.89 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.545 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 15.4 p-10 -97.33 67.7 2.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.857 0.837 . . . . 0.0 111.728 -168.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.627 HD21 ' HB2' ' A' ' 53' ' ' GLN . 37.7 mt -94.71 124.78 38.95 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.542 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 t -110.65 148.64 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.26 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.0 tt -122.27 118.77 29.33 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.824 0.345 . . . . 0.0 110.799 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.6 mt -90.85 131.56 36.41 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.56 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -128.53 125.08 37.59 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.904 0.383 . . . . 0.0 111.519 -178.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.99 134.5 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 120.869 0.366 . . . . 0.0 111.128 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -74.53 138.4 43.09 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 175.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.416 ' O ' ' HG ' ' A' ' 66' ' ' LEU . . . -48.39 -70.51 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.496 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 28.2 mt-10 61.24 167.98 0.09 OUTLIER Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.496 ' HD2' ' HB3' ' A' ' 64' ' ' GLU . 82.8 Cg_exo -52.24 5.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.503 0 C-N-CA 123.711 2.941 . . . . 0.0 116.356 176.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 63' ' ' ALA . 4.3 pp -88.35 10.34 20.23 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.315 -0.865 . . . . 0.0 111.656 178.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -71.83 27.13 0.63 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.504 0.562 . . . . 0.0 114.504 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.17 -35.4 9.67 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.23 -0.571 . . . . 0.0 110.247 173.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -78.76 -12.69 60.03 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.13 175.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 4' ' ' ILE . 51.5 tp -114.0 134.19 55.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.814 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -137.25 134.57 36.33 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.966 0.413 . . . . 0.0 111.416 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.515 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 73.0 m95 -83.66 89.41 7.12 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.97 0.414 . . . . 0.0 110.721 177.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.39 117.6 31.2 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.097 0.475 . . . . 0.0 112.131 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.436 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -89.49 114.12 25.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.037 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.3 m -117.78 36.24 4.38 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -164.26 -36.38 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 0.0 111.657 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 141.17 100.58 0.42 Allowed Glycine 0 CA--C 1.526 0.723 0 C-N-CA 121.182 -0.533 . . . . 0.0 113.038 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.8 -47.05 3.72 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.18 104.45 1.82 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 122.414 -0.463 . . . . 0.0 111.484 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.515 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 50.4 mtm180 -92.9 107.82 19.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.962 0.411 . . . . 0.0 111.365 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -84.31 114.68 56.25 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.408 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.51 111.45 1.66 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.406 2.071 . . . . 0.0 112.245 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.576 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 57.8 m170 -106.6 133.93 50.52 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.589 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.8 tp -100.22 120.42 39.87 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.924 0.392 . . . . 0.0 110.293 177.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -79.52 7.09 8.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -174.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -145.43 155.43 53.64 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 122.357 -0.214 . . . . 0.0 111.116 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.31 135.75 61.06 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.683 2.256 . . . . 0.0 113.072 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 61.5 tp -80.49 88.72 5.62 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.053 0.454 . . . . 0.0 111.232 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.2 mt -61.36 141.84 57.33 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.282 -0.261 . . . . 0.0 110.532 176.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 87.9 t -58.17 -27.45 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.05 0.453 . . . . 0.0 111.138 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.2 t -65.69 -23.7 66.83 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.36 -21.12 53.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.782 0.325 . . . . 0.0 111.536 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.8 t -76.73 87.86 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.05 0.453 . . . . 0.0 110.929 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.529 HG22 ' HG3' ' A' ' 95' ' ' ARG . 97.8 m -59.87 -48.55 81.23 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.115 -178.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.529 ' HG3' HG22 ' A' ' 94' ' ' THR . 69.2 mtm180 -134.12 148.13 50.94 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.633 0.254 . . . . 0.0 111.345 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -157.74 153.33 26.4 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.749 0.309 . . . . 0.0 111.609 177.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -169.18 151.26 4.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -73.14 126.31 29.73 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.74 174.83 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -170.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 23.4 t70 -107.91 129.16 55.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.616 -177.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.581 HD21 HD12 ' A' ' 56' ' ' LEU . 80.9 mt -96.56 152.06 18.99 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.993 0.425 . . . . 0.0 111.91 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.658 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 28.1 t70 -86.3 174.71 8.88 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.92 177.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.33 65.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -96.27 9.42 41.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.139 0.495 . . . . 0.0 111.052 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.503 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 93.52 -33.98 4.86 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 121.243 -0.503 . . . . 0.0 113.658 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.8 t -54.41 122.82 40.13 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.436 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 31.2 Cg_exo -59.84 103.97 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 112.264 176.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.658 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 83.6 mm-40 -76.55 68.36 2.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.444 0.64 . . . . 0.0 111.77 -177.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 112' ' ' HIS . 2.3 pp -100.32 5.39 44.47 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.538 176.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.93 -49.3 72.26 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.482 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.16 -19.62 62.4 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.215 0.531 . . . . 0.0 111.079 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' HIS . . . . . 0.455 ' HB3' ' O ' ' A' ' 109' ' ' LEU . 73.3 t60 -76.73 -30.1 56.48 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.349 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.443 HD22 ' CZ ' ' A' ' 5' ' ' TYR . 30.5 mt . . . . . 0 CA--C 1.542 0.641 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.131 -179.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.1 0.476 . . . . 0.0 110.752 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.8 mt -87.8 113.77 23.78 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -174.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.566 HD12 HD22 ' A' ' 36' ' ' LEU . 25.7 pt -98.51 141.79 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 170.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.511 ' HB3' HD11 ' A' ' 58' ' ' LEU . 92.2 m-85 -117.38 147.4 42.68 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.657 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 77.7 tttt -151.93 118.1 5.56 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -93.19 149.57 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-O 120.96 0.41 . . . . 0.0 111.678 -176.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -160.27 171.44 19.16 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.99 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -79.89 145.65 32.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.86 0.362 . . . . 0.0 111.148 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.43 -29.99 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.524 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.03 -59.48 5.29 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.381 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.86 -34.31 74.4 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.823 0.344 . . . . 0.0 111.639 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -64.32 -47.73 78.3 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.912 0.387 . . . . 0.0 111.869 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.23 -40.12 86.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.464 0.65 . . . . 0.0 110.125 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.68 72.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.027 174.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.91 97.94 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 174.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.54 -35.83 78.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.294 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.17 -27.43 63.82 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.925 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -109.28 -0.78 18.98 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.011 0.434 . . . . 0.0 111.61 176.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.13 -0.53 46.46 Favored Glycine 0 CA--C 1.53 1.013 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 176.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -136.16 155.27 50.39 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.948 -0.737 . . . . 0.0 111.582 -175.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.657 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 44.1 t80 -128.95 160.8 31.54 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.072 172.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.557 ' HB3' HD13 ' A' ' 34' ' ' ILE . 67.1 mt-10 73.96 -168.39 0.11 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.599 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.21 22.44 70.88 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.304 -173.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.3 t -88.39 -177.23 5.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.896 0.478 . . . . 0.0 111.573 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.43 -42.49 32.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.1 t -56.79 -39.61 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 120.903 0.382 . . . . 0.0 111.717 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.34 -50.83 58.34 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.088 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.88 -27.26 68.08 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.79 0.329 . . . . 0.0 111.688 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.44 -56.03 4.89 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.069 0.461 . . . . 0.0 112.039 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -80.49 -29.71 37.35 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 118.25 -27.42 7.35 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.975 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -152.08 166.5 31.42 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.212 0.529 . . . . 0.0 111.597 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.557 HD13 ' HB3' ' A' ' 23' ' ' GLU . 50.4 mt -80.18 149.44 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.798 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -111.86 121.19 44.36 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.007 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.622 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 6.2 mp -119.28 -175.42 2.93 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 171.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.9 m -146.71 153.4 40.21 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.05 -166.83 1.7 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.824 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.8 -69.99 1.11 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 114.138 0.415 . . . . 0.0 114.138 -175.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.18 88.25 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.922 0.392 . . . . 0.0 111.59 -177.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -61.34 -46.24 91.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.489 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -62.07 -42.59 99.36 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.742 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -59.9 -48.72 80.55 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 120.989 0.424 . . . . 0.0 111.555 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -73.12 -41.29 64.16 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.4 m -59.5 -42.0 91.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.973 0.416 . . . . 0.0 111.104 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.444 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.87 -42.49 89.55 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.063 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.21 68.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -82.44 -63.22 1.42 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.07 0.462 . . . . 0.0 112.058 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -74.31 -40.13 62.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -172.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -117.02 34.45 5.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.128 0.489 . . . . 0.0 110.907 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 51' ' ' ARG . 2.9 ptm180 -36.06 -52.7 0.77 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -176.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.633 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -156.29 47.25 0.49 Allowed Glycine 0 CA--C 1.522 0.524 0 C-N-CA 120.858 -0.687 . . . . 0.0 113.495 -176.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.581 ' HB2' HD21 ' A' ' 56' ' ' LEU . 64.2 mt-30 -87.5 158.5 18.92 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.722 0.296 . . . . 0.0 110.893 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.38 128.89 34.99 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 67.56 84.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.828 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.581 HD21 ' HB2' ' A' ' 53' ' ' GLN . 96.1 mt -112.69 129.83 56.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.531 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.419 ' O ' HD23 ' A' ' 8' ' ' LEU . 60.3 t -102.64 130.79 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.057 0.456 . . . . 0.0 111.439 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.6 tp -99.44 104.03 15.85 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 175.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.427 HD22 HG11 ' A' ' 93' ' ' VAL . 82.7 mt -76.29 109.81 10.29 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.075 0.464 . . . . 0.0 111.376 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.474 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -101.12 115.84 31.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.41 175.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 4' ' ' ILE . 51.8 t -126.24 131.86 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.636 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 18.6 tt0 -92.22 105.28 17.53 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.17 0.509 . . . . 0.0 111.985 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.58 84.85 7.06 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.425 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.595 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 41.2 mt-10 -80.58 -44.8 1.32 Allowed Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 178.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 10.9 Cg_endo -53.9 -62.27 0.33 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.828 1.685 . . . . 0.0 112.294 177.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 70' ' ' LEU . 18.6 tp 57.13 22.92 7.97 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.23 0.538 . . . . 0.0 111.985 172.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -93.77 -83.31 1.57 Allowed Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.501 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -102.34 5.56 39.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.029 0.442 . . . . 0.0 111.167 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.516 ' O ' HD12 ' A' ' 84' ' ' LEU . 4.0 p-10 -92.79 -64.17 1.13 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.182 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.58 ' HB3' HD12 ' A' ' 66' ' ' LEU . 42.0 tp -107.89 147.7 30.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.916 0.388 . . . . 0.0 111.09 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -136.63 101.04 4.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.006 0.432 . . . . 0.0 111.94 -174.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -70.28 119.82 15.03 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -158.32 144.63 17.27 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.602 -172.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.46 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -149.51 158.1 43.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.251 0.548 . . . . 0.0 112.407 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.6 m -154.78 126.74 7.64 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.176 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 76' ' ' ARG . 3.8 mpt_? 69.83 -59.99 0.49 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 176.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.2 -15.38 44.16 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.352 0.501 . . . . 0.0 114.352 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 79.2 -45.07 2.74 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.608 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.81 134.86 57.51 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.931 0.396 . . . . 0.0 112.047 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.46 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 83.6 mtt180 -79.1 110.89 14.77 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.153 -177.674 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 80.2 m-85 -95.17 117.64 66.69 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-O 120.756 0.313 . . . . 0.0 111.712 -177.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 81' ' ' PHE . 18.5 Cg_exo -66.82 102.19 0.61 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.661 2.24 . . . . 0.0 112.374 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -90.94 115.4 27.94 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.133 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.516 HD12 ' O ' ' A' ' 69' ' ' ASP . 55.2 tp -105.24 130.57 53.36 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.707 0.289 . . . . 0.0 110.543 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -110.32 37.11 2.82 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 20.5 ptp180 -167.55 138.42 2.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 O-C-N 122.452 -0.155 . . . . 0.0 110.986 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 26.8 Cg_exo -62.48 149.33 91.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 122.721 2.281 . . . . 0.0 113.046 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -108.99 118.56 37.11 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.33 0.586 . . . . 0.0 111.282 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -71.04 135.56 47.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.058 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 30.0 m -57.88 -35.24 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -172.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -72.54 -3.77 26.56 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.729 0.3 . . . . 0.0 111.722 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -98.01 -11.86 22.55 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.808 0.337 . . . . 0.0 111.77 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.427 HG11 HD22 ' A' ' 59' ' ' LEU . 57.6 t -66.61 124.81 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 O-C-N 122.319 -0.238 . . . . 0.0 111.407 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 40.8 m -59.72 -38.83 82.74 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.768 0.318 . . . . 0.0 111.645 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -160.85 143.13 12.55 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.301 0.572 . . . . 0.0 112.231 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.3 pt-20 -106.7 84.07 1.95 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.489 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.52 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -74.6 84.31 2.06 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.216 0.532 . . . . 0.0 112.209 -175.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 102.22 1.59 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.573 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 pp -116.15 168.37 10.17 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -122.87 176.12 6.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.521 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.633 HD11 ' HA2' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -158.74 179.07 9.44 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.816 -179.221 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -113.87 170.28 8.38 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.478 0.656 . . . . 0.0 112.127 170.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.75 94.02 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.366 -178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 91.25 -6.58 0.26 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.791 0.836 . . . . 0.0 109.678 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -60.19 -39.89 96.54 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.501 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 t 67.13 141.14 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 123.951 0.442 . . . . 0.0 112.153 169.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.558 ' HD3' HD13 ' A' ' 101' ' ' LEU . 53.2 Cg_exo -35.01 101.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 123.138 2.559 . . . . 0.0 113.888 -173.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -70.4 80.22 0.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.567 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.4 mp -79.39 -23.56 43.2 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.307 -0.406 . . . . 0.0 112.072 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.59 -41.5 26.17 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.635 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -78.05 -13.67 59.79 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 26.1 m170 -95.58 -13.12 24.67 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.615 0.245 . . . . 0.0 111.173 179.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 42.7 mt . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -175.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 53.3 p . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.7 mt -81.98 105.96 13.51 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.987 -0.446 . . . . 0.0 111.406 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.44 ' CG2' ' HB3' ' A' ' 36' ' ' LEU . 13.6 mt -92.35 142.92 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.19 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -130.72 119.42 22.33 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.664 0.269 . . . . 0.0 111.609 -177.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 35' ' ' HIS . 33.8 ttpt -127.24 123.06 35.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.651 0.262 . . . . 0.0 111.673 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.479 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.1 mp -91.69 138.14 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -178.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.42 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.8 pt? -149.69 174.54 12.46 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.189 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.413 ' OG ' ' HG2' ' A' ' 12' ' ' GLU . 83.9 p -82.48 151.97 26.28 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.943 -0.473 . . . . 0.0 111.063 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -30.06 64.37 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.832 0.348 . . . . 0.0 110.497 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.37 39.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.26 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HG2' ' OG ' ' A' ' 9' ' ' SER . 12.3 mm-40 -58.29 -43.55 88.11 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 111.144 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.52 ' CH2' HG13 ' A' ' 90' ' ' VAL . 28.4 t-105 -62.74 -51.74 65.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.678 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.56 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 12.4 t70 -59.44 -47.42 85.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.327 0.584 . . . . 0.0 110.784 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.41 -46.71 76.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.467 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.72 74.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.56 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 10.4 mtmp? -65.71 -27.92 68.68 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.683 0.278 . . . . 0.0 110.958 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.27 83.68 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.135 0.493 . . . . 0.0 111.091 173.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -80.23 -26.53 39.04 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.235 0.541 . . . . 0.0 110.856 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.06 -10.77 51.87 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.447 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HG2' HD13 ' A' ' 89' ' ' LEU . 24.8 mtt-85 -135.73 121.68 19.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.59 -0.359 . . . . 0.0 110.821 -178.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -78.6 86.67 4.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 172.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.11 80.27 9.24 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.194 0.521 . . . . 0.0 112.089 -174.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.67 -135.35 48.68 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.58 -0.737 . . . . 0.0 114.565 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.494 ' O ' ' HB3' ' A' ' 28' ' ' ASP . 46.5 t 170.42 177.48 0.05 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.627 0.771 . . . . 0.0 110.25 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.41 -49.12 77.24 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 122.003 -0.436 . . . . 0.0 111.865 -179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.493 HG22 ' NE2' ' A' ' 35' ' ' HIS . 10.7 p -65.33 -24.52 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 111.597 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.494 ' HB3' ' O ' ' A' ' 25' ' ' SER . 0.3 OUTLIER -64.12 -53.66 46.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.758 175.094 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.27 -30.61 68.42 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 120.621 0.248 . . . . 0.0 111.082 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.17 77.92 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.868 0.366 . . . . 0.0 111.709 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.51 ' HB3' ' CD1' ' A' ' 33' ' ' PHE . 3.5 m-20 -87.91 -29.67 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.103 0.477 . . . . 0.0 111.566 173.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.18 -6.67 81.28 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.902 -170.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.608 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -151.45 143.81 24.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.225 0.61 . . . . 0.0 111.092 -177.903 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mt -60.53 130.42 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -168.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.493 ' NE2' HG22 ' A' ' 27' ' ' VAL . 33.7 m-70 -72.45 140.12 48.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.736 170.045 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB3' ' CG2' ' A' ' 4' ' ' ILE . 3.4 mp -145.61 -64.51 0.32 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.68 0.276 . . . . 0.0 110.714 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 56.2 m 78.71 160.29 0.19 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.81 177.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -97.72 177.58 5.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.864 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -41.86 -47.97 5.13 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 114.677 0.631 . . . . 0.0 114.677 -175.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -54.61 -69.02 0.14 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.426 0.631 . . . . 0.0 111.781 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 22.2 mp0 -68.91 -20.09 64.22 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.888 -175.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.96 -56.52 8.71 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.698 0.285 . . . . 0.0 111.358 178.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -61.74 -39.82 92.92 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 111.728 0.269 . . . . 0.0 111.728 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -58.97 -56.4 22.75 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.979 0.419 . . . . 0.0 110.935 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -56.02 -34.02 65.44 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.122 176.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.54 -49.42 73.55 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.624 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.24 -33.07 74.69 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.054 0.454 . . . . 0.0 111.911 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -77.05 -53.03 8.31 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.36 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -88.79 -42.26 12.02 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -174.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -112.74 57.12 0.66 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.169 0.509 . . . . 0.0 110.713 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -4.54 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -172.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.88 73.63 0.02 OUTLIER Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.372 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.573 ' HB2' HD21 ' A' ' 56' ' ' LEU . 88.0 mt-30 -107.3 26.0 10.73 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 121.452 0.644 . . . . 0.0 110.996 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 64.46 -78.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.49 63.22 7.22 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.576 0.703 . . . . 0.0 111.367 -172.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.693 HD12 HD21 ' A' ' 101' ' ' LEU . 52.2 mt -88.5 138.92 31.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.606 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' HD23 ' A' ' 8' ' ' LEU . 59.7 t -123.51 141.92 42.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.648 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 8.8 tt -109.38 115.4 29.88 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.899 0.38 . . . . 0.0 110.615 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.1 108.59 13.82 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.87 0.366 . . . . 0.0 111.317 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.04 110.38 22.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.5 t -120.01 116.68 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.45 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.445 ' HG2' ' OG1' ' A' ' 94' ' ' THR . 11.8 pt-20 -79.41 103.38 9.29 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.594 0.711 . . . . 0.0 110.902 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.16 40.62 0.27 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.142 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -75.85 -45.89 3.98 Favored Pre-proline 0 CA--C 1.548 0.888 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -83.75 -157.23 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 122.216 1.944 . . . . 0.0 112.374 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 69' ' ' ASP . 90.5 mt 67.83 -55.38 0.49 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.366 1.066 . . . . 0.0 112.072 -177.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.08 -102.94 1.3 Allowed Glycine 0 CA--C 1.528 0.906 0 CA-C-N 116.213 -0.449 . . . . 0.0 113.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -69.82 -13.92 62.5 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 66' ' ' LEU . 58.1 m-20 -67.27 -17.62 64.87 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.5 tp -123.33 149.88 44.32 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.456 ' NZ ' ' OH ' ' A' ' 85' ' ' TYR . 8.1 ttpm? -149.25 128.36 12.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.925 0.393 . . . . 0.0 111.308 171.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.416 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 53.4 m95 -72.55 86.79 1.19 Allowed 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -86.17 128.89 34.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.961 -169.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.586 ' HB2' HH11 ' A' ' 80' ' ' ARG . . . -76.58 152.01 36.09 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.482 0.658 . . . . 0.0 112.729 -176.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.0 t -130.93 -178.64 4.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.0 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -55.44 103.45 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.913 0.485 . . . . 0.0 111.682 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.25 -16.62 5.7 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.473 -0.394 . . . . 0.0 112.916 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.45 -2.64 59.18 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.324 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.51 140.35 57.99 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.704 -0.292 . . . . 0.0 111.757 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.586 HH11 ' HB2' ' A' ' 74' ' ' ALA . 24.9 mmm180 -102.66 111.91 24.44 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.734 0.302 . . . . 0.0 111.262 -177.278 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -107.45 114.15 61.06 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-O 120.637 0.256 . . . . 0.0 111.364 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 37' ' ' SER . 43.6 Cg_endo -67.37 103.09 0.75 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.35 2.034 . . . . 0.0 112.819 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 31.3 m80 -98.91 129.82 45.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.928 176.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.43 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 36.3 tp -95.07 137.26 34.37 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.456 ' OH ' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 m-85 -105.61 12.91 30.65 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -173.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.43 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 44.4 mtm180 -141.67 154.44 66.14 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 122.664 0.386 . . . . 0.0 110.695 173.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.6 132.63 52.96 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.532 2.155 . . . . 0.0 113.105 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.6 tp -79.3 105.45 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.863 0.363 . . . . 0.0 111.707 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.427 HD13 ' HG2' ' A' ' 21' ' ' ARG . 3.7 mm? -63.98 123.53 19.24 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.238 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.52 HG13 ' CH2' ' A' ' 13' ' ' TRP . 76.3 t -56.2 -39.44 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.955 0.407 . . . . 0.0 111.815 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.6 t -72.96 -4.53 32.74 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -99.56 -11.49 20.96 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 120.998 0.428 . . . . 0.0 111.378 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -69.25 135.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-O 120.933 0.397 . . . . 0.0 111.706 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.445 ' OG1' ' HG2' ' A' ' 62' ' ' GLU . 61.3 m -65.15 -50.0 67.67 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.064 0.459 . . . . 0.0 111.597 -179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -155.31 143.09 19.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.284 0.564 . . . . 0.0 111.671 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.4 pt-20 -97.15 86.49 3.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.335 171.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.486 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -75.98 86.45 2.9 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -171.145 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -66.81 139.28 57.77 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.924 172.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.455 ' N ' HD23 ' A' ' 99' ' ' LEU . 2.0 pt? -141.2 145.11 35.21 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.143 0.497 . . . . 0.0 112.088 -177.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.63 131.82 34.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.395 172.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.693 HD21 HD12 ' A' ' 56' ' ' LEU . 88.4 mt -71.14 149.84 46.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.119 0.485 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.82 166.15 3.55 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.639 175.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.84 66.8 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.126 0.489 . . . . 0.0 111.7 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -83.41 -10.93 58.11 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.501 0.667 . . . . 0.0 110.078 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.94 18.89 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.695 -0.684 . . . . 0.0 113.008 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 73.4 t -103.91 123.43 41.07 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 83.04 1.04 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 170.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -80.25 115.37 19.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.433 0.635 . . . . 0.0 112.227 -174.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -88.63 -29.92 19.59 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -47.24 -46.12 21.41 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.414 -0.422 . . . . 0.0 113.556 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -64.93 -40.29 94.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.858 0.361 . . . . 0.0 111.575 177.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -79.02 -24.17 43.86 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -174.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 46.6 mt . . . . . 0 CA--C 1.542 0.658 0 O-C-N 122.321 -0.237 . . . . 0.0 111.287 -178.419 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.448 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 pmm? . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m 72.48 -48.53 0.68 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.321 0.649 . . . . 0.0 112.663 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -69.61 96.1 0.91 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.711 173.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 pt -92.2 147.32 5.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.751 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.532 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 43.2 m-85 -119.79 147.44 44.64 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -170.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -126.79 123.59 37.74 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.553 171.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.0 mt -96.56 130.1 45.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.731 0.3 . . . . 0.0 111.468 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -147.71 174.55 11.69 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.811 176.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.4 t -79.79 143.97 33.97 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.797 0.332 . . . . 0.0 111.301 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -55.92 -44.1 78.01 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.68 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.5 -37.72 57.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 111.927 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.56 -41.64 65.54 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.131 0.491 . . . . 0.0 110.893 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -64.45 -49.44 71.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.976 -0.557 . . . . 0.0 112.166 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -58.03 -39.53 78.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.717 0.294 . . . . 0.0 111.559 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -50.64 71.43 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.954 0.407 . . . . 0.0 111.241 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -41.7 89.3 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.163 0.506 . . . . 0.0 111.402 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.402 ' HA ' HG21 ' A' ' 90' ' ' VAL . 24.5 ttmm -63.48 -31.08 72.14 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.08 -40.73 78.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -76.41 -30.55 57.49 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.9 1.14 82.81 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.053 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -141.07 146.56 37.3 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.864 0.364 . . . . 0.0 111.966 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -128.04 99.75 5.61 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.12 0.486 . . . . 0.0 110.283 173.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.476 ' H ' ' CD ' ' A' ' 23' ' ' GLU . 3.6 pm0 -71.83 163.89 27.0 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.068 0.461 . . . . 0.0 111.563 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.73 111.46 4.2 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.229 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -67.19 158.39 31.43 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.716 0.293 . . . . 0.0 111.645 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.09 -37.12 43.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.975 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.88 -49.04 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 111.292 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.492 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 8.2 m-20 -62.71 -46.23 89.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.57 -33.24 75.45 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.666 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.29 -37.09 86.25 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.978 0.418 . . . . 0.0 111.78 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -81.42 -51.63 8.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.146 0.498 . . . . 0.0 111.291 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 153.46 71.44 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.416 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 68.64 -176.69 0.21 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.897 0.479 . . . . 0.0 111.597 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.66 103.11 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.302 0.572 . . . . 0.0 111.618 -175.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 8.2 p80 -86.55 106.45 17.55 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.23 0.538 . . . . 0.0 112.218 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -91.55 166.31 12.9 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.1 p -142.72 140.58 31.54 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.902 -0.499 . . . . 0.0 112.163 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.03 157.58 34.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.942 176.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.62 -48.3 8.89 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 114.383 0.513 . . . . 0.0 114.383 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.02 -42.67 89.37 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.188 0.518 . . . . 0.0 111.516 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.88 -40.72 91.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.484 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.41 76.49 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.62 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.736 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 13.1 tm0? -56.58 -50.33 72.27 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -58.06 -56.79 17.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.16 0.505 . . . . 0.0 111.837 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 34.3 m -59.78 -31.24 69.5 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.026 0.441 . . . . 0.0 111.115 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 107' ' ' PRO . . . -62.68 -45.2 93.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.103 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.551 ' HA ' HG13 ' A' ' 106' ' ' VAL . . . -66.0 -33.71 76.42 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.976 0.417 . . . . 0.0 111.855 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.7 -54.05 6.24 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -106.82 -40.7 5.42 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -169.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.2 m-85 -85.64 2.5 44.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.072 0.463 . . . . 0.0 112.186 -173.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.654 ' HA ' ' HD3' ' A' ' 107' ' ' PRO . 45.0 ptt85 -57.25 141.15 47.65 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.547 175.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.48 -17.81 22.58 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.063 -0.589 . . . . 0.0 113.928 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -87.55 97.45 10.86 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.282 0.563 . . . . 0.0 111.287 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.18 54.12 0.97 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.049 0.452 . . . . 0.0 111.894 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -158.8 36.37 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.42 0.628 . . . . 0.0 110.57 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -95.66 155.42 16.75 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.503 -173.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.1 t -123.75 130.27 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.328 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.1 tp -98.4 103.93 15.92 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.639 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.532 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 79.8 mt -86.89 113.9 23.08 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.51 124.45 40.5 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.926 0.393 . . . . 0.0 111.963 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.0 t -124.65 132.01 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 122.788 0.435 . . . . 0.0 110.887 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' A' ' 64' ' ' GLU . 38.7 mt-10 -79.4 66.1 4.76 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . 34.16 -78.41 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.1 mm-40 73.18 132.72 0.04 OUTLIER Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 123.705 0.802 . . . . 0.0 111.779 -170.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 64' ' ' GLU . 12.8 Cg_exo -70.38 26.16 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.574 2.85 . . . . 0.0 114.903 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.85 59.41 4.12 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.387 0.613 . . . . 0.0 111.756 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' A' ' 70' ' ' LEU . . . -58.76 -11.49 10.99 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 115.751 -0.659 . . . . 0.0 114.062 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.81 -42.32 99.67 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.723 0.409 . . . . 0.0 111.831 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -105.61 -30.95 9.17 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.485 HD11 ' HB2' ' A' ' 82' ' ' PRO . 57.5 tp -104.7 101.8 11.41 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.954 0.407 . . . . 0.0 110.762 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -114.04 124.04 51.16 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -69.97 80.09 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.567 0.699 . . . . 0.0 109.132 171.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -100.5 137.39 38.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.236 -169.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -74.81 95.05 2.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.45 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 t -72.74 146.39 46.45 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.088 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 57.22 20.21 5.53 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.843 0.354 . . . . 0.0 111.886 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.03 42.3 99.66 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.351 -176.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.02 -99.69 0.32 Allowed Glycine 0 CA--C 1.531 1.059 0 C-N-CA 120.745 -0.741 . . . . 0.0 114.027 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -80.11 145.1 32.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -86.31 96.0 9.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.978 0.418 . . . . 0.0 111.6 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.7 129.14 39.19 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' HB2' HD11 ' A' ' 70' ' ' LEU . 33.2 Cg_endo -64.76 100.34 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.515 2.143 . . . . 0.0 112.723 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -93.38 126.88 38.75 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.471 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 tp -92.5 116.05 28.64 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.402 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -84.22 22.32 1.24 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -149.77 156.92 38.64 Favored Pre-proline 0 CA--C 1.54 0.569 0 O-C-N 122.28 -0.262 . . . . 0.0 110.552 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.24 140.91 32.7 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.879 2.386 . . . . 0.0 113.852 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -89.45 98.1 11.58 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.079 0.466 . . . . 0.0 111.061 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.55 132.58 47.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.784 0.326 . . . . 0.0 110.754 176.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.402 HG21 ' HA ' ' A' ' 17' ' ' LYS . 98.2 t -59.7 -39.23 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 120.934 0.397 . . . . 0.0 111.302 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 64.1 m -68.33 -8.96 44.45 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -88.71 -28.17 20.73 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.031 0.444 . . . . 0.0 110.967 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.3 t -66.37 143.4 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.438 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.465 HG22 ' HG3' ' A' ' 95' ' ' ARG . 93.3 m -74.05 -65.08 0.88 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.723 0.297 . . . . 0.0 111.192 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 94' ' ' THR . 37.3 mtp85 -148.15 159.55 43.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.143 0.496 . . . . 0.0 111.853 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -110.37 162.1 14.98 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.703 175.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.9 107.77 3.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.619 0.247 . . . . 0.0 111.474 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -60.2 120.1 9.14 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.011 0.434 . . . . 0.0 110.612 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 100' ' ' ASP . 2.8 tm? -111.27 132.88 54.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.196 -172.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.443 ' N ' HD13 ' A' ' 99' ' ' LEU . 4.2 t70 -124.26 -179.27 4.38 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 120.903 0.382 . . . . 0.0 111.499 -177.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.1 mt -94.66 165.76 12.35 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -173.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.569 ' HB3' ' HB2' ' A' ' 108' ' ' GLN . 5.7 p-10 -106.29 -162.99 0.89 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.109 0.481 . . . . 0.0 111.174 174.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.48 -30.59 68.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -89.72 -3.31 58.26 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.82 19.18 68.42 Favored Glycine 0 CA--C 1.525 0.685 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.956 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.551 HG13 ' HA ' ' A' ' 47' ' ' ALA . 74.2 t -99.8 137.76 20.24 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 122.862 0.465 . . . . 0.0 110.927 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.654 ' HD3' ' HA ' ' A' ' 51' ' ' ARG . 76.0 Cg_exo -51.66 101.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.152 1.901 . . . . 0.0 111.15 171.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 102' ' ' ASP . 53.9 tp60 -79.26 82.79 5.37 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -167.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.736 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 8.3 mp -83.98 -14.03 51.8 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.785 171.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.623 ' HA2' HD22 ' A' ' 115' ' ' LEU . . . -57.14 -41.5 92.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.891 176.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -83.21 -29.1 28.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 174.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' HIS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 109' ' ' LEU . 75.8 t60 -76.11 -21.08 57.06 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.891 0.377 . . . . 0.0 111.817 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.565 ' HB2' HD13 ' A' ' 115' ' ' LEU . 72.7 mt -113.64 -171.77 1.95 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.151 0.5 . . . . 0.0 111.307 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -83.38 16.94 2.29 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -175.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.623 HD22 ' HA2' ' A' ' 110' ' ' GLY . 9.9 mp -64.57 -20.14 66.06 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 CA--C 1.54 0.585 0 CA-C-O 121.0 0.429 . . . . 0.0 110.975 174.639 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ttt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.704 0.287 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.545 ' O ' ' HA ' ' A' ' 62' ' ' GLU . 74.7 p -142.77 123.1 13.86 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.419 0.288 . . . . 0.0 110.849 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.539 HD12 ' HB1' ' A' ' 60' ' ' ALA . 3.8 mm? -83.5 122.86 29.11 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.254 0.549 . . . . 0.0 112.281 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 61' ' ' VAL . 15.6 pt -108.74 143.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.72 171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.504 ' HB3' HD11 ' A' ' 58' ' ' LEU . 40.0 m-85 -120.46 144.53 47.93 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -166.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -150.29 120.13 7.1 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.232 170.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 59.7 mt -92.49 129.74 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.942 0.401 . . . . 0.0 111.928 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -119.51 161.35 20.72 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.067 0.46 . . . . 0.0 111.731 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.5 p -83.51 142.48 30.87 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 166.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -52.22 -37.79 56.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.4 -42.95 67.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.39 -54.65 7.17 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.327 0.584 . . . . 0.0 111.626 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.485 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 50.0 t-105 -68.09 -32.59 73.02 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -64.88 -43.5 92.71 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.58 0.705 . . . . 0.0 110.124 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.26 81.83 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.01 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.67 -45.24 81.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.076 174.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.4 mttm -58.31 -39.21 78.77 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.011 0.434 . . . . 0.0 110.914 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.16 -30.25 71.33 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.141 0.496 . . . . 0.0 111.614 178.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -88.67 -28.02 20.87 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.817 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.42 -4.51 85.24 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.992 -170.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.599 ' HG3' HD23 ' A' ' 89' ' ' LEU . 46.1 ttp180 -146.16 141.56 27.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.462 0.305 . . . . 0.0 111.27 -178.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -103.73 141.4 36.15 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.137 0.494 . . . . 0.0 110.546 171.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -73.78 -165.27 0.27 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.58 -83.64 1.06 Allowed Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.375 -0.917 . . . . 0.0 111.675 172.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.43 ' H ' HD23 ' A' ' 29' ' ' LEU . 30.0 t 163.96 163.31 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.473 1.109 . . . . 0.0 109.426 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.27 57.38 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.244 0.545 . . . . 0.0 110.642 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.0 t -72.72 -55.08 14.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.291 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -51.95 -46.09 64.61 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.95 0.405 . . . . 0.0 111.97 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.43 HD23 ' H ' ' A' ' 25' ' ' SER . 4.0 mm? -73.18 -25.33 60.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.28 86.15 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.147 0.498 . . . . 0.0 110.932 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.39 -39.81 74.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.293 0.568 . . . . 0.0 110.526 170.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.17 -4.51 18.27 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.681 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -165.6 163.05 19.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.824 0.345 . . . . 0.0 110.986 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -72.9 129.29 36.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.171 0.51 . . . . 0.0 111.399 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -124.14 106.71 10.55 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.121 0.486 . . . . 0.0 111.049 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.436 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 72.3 mt -86.54 175.29 8.41 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.173 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.5 p -128.58 153.63 47.03 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.985 0.421 . . . . 0.0 112.067 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.449 ' H ' ' CG ' ' A' ' 41' ' ' GLN . . . -98.36 -174.13 2.75 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.798 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -46.48 -66.12 1.87 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 114.943 0.737 . . . . 0.0 114.943 -173.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.29 -54.99 40.52 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 121.234 0.54 . . . . 0.0 111.926 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' CG ' ' H ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.99 -34.53 76.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.419 -177.21 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.98 -46.59 62.04 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.878 0.37 . . . . 0.0 111.093 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.429 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 8.3 tm0? -61.32 -41.82 97.65 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.2 -53.9 48.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 110.664 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.514 HG23 ' CD1' ' A' ' 49' ' ' TRP . 68.6 m -53.09 -38.68 62.78 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.934 0.397 . . . . 0.0 111.436 177.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.604 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -60.37 -39.01 85.69 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.58 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -82.08 -24.86 34.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.796 178.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.05 -64.79 1.11 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.149 0.5 . . . . 0.0 112.237 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.514 ' CD1' HG23 ' A' ' 45' ' ' THR . 52.9 m95 -91.65 -24.99 19.35 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.436 ' HA ' ' HG3' ' A' ' 53' ' ' GLN . 62.6 m-85 -108.1 17.6 22.13 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 40.1 ttm180 -73.09 115.6 12.61 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.81 29.67 54.12 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.135 -0.555 . . . . 0.0 114.154 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.436 ' HG3' ' HA ' ' A' ' 50' ' ' PHE . 83.5 mm-40 -88.38 -163.74 1.01 Allowed 'General case' 0 N--CA 1.473 0.716 0 O-C-N 122.446 -0.444 . . . . 0.0 111.586 177.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.32 136.08 31.19 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.526 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 55.25 81.31 0.11 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.0 mt -109.09 119.86 40.82 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.473 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 13' ' ' TRP . 21.5 t -104.99 116.61 49.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 120.831 0.348 . . . . 0.0 111.182 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 5' ' ' TYR . 63.4 tp -88.17 111.53 21.72 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.784 0.326 . . . . 0.0 111.18 178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.8 mt -83.45 119.28 24.47 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.802 0.334 . . . . 0.0 110.836 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HB1' HD12 ' A' ' 3' ' ' LEU . . . -116.02 96.25 5.49 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.108 0.48 . . . . 0.0 111.157 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 4' ' ' ILE . 36.5 t -106.08 139.27 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 2' ' ' THR . 24.5 mt-10 -89.81 127.21 35.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.974 -0.454 . . . . 0.0 110.512 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -36.37 -52.33 0.83 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 68.97 133.82 0.04 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 CA-C-O 120.868 0.366 . . . . 0.0 111.653 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.05 53.3 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 122.553 2.169 . . . . 0.0 112.888 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.09 -23.22 67.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.868 0.467 . . . . 0.0 112.201 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 139.48 -88.69 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.325 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -149.81 25.84 0.83 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 122.129 0.966 . . . . 0.0 109.928 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.56 -42.87 98.32 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.544 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 82' ' ' PRO . 17.8 tp -100.25 105.8 17.4 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.049 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -103.56 107.88 18.92 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.901 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 71.7 m95 -73.54 112.53 9.71 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.811 0.338 . . . . 0.0 111.395 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.558 ' HB2' ' CE1' ' A' ' 83' ' ' HIS . 36.5 mt-10 -139.53 134.19 31.86 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.094 0.473 . . . . 0.0 111.065 -178.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.819 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -70.32 96.53 1.14 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.035 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m -69.41 -23.87 63.77 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.856 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -118.95 28.34 8.34 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.719 0.295 . . . . 0.0 111.411 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.24 -80.75 0.72 Allowed Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.974 -0.631 . . . . 0.0 113.393 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.92 49.04 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.911 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -85.25 121.6 28.23 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.575 -0.368 . . . . 0.0 111.679 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.819 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 63.3 mtm180 -85.73 149.55 25.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.005 0.431 . . . . 0.0 111.407 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -136.28 126.01 16.03 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.402 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HB2' HD11 ' A' ' 70' ' ' LEU . 49.0 Cg_endo -68.78 111.94 2.75 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 122.4 2.067 . . . . 0.0 112.495 175.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.558 ' CE1' ' HB2' ' A' ' 73' ' ' GLU . 53.5 m170 -91.45 137.36 32.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.857 0.361 . . . . 0.0 111.789 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -117.17 118.82 33.36 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.844 0.354 . . . . 0.0 110.231 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -96.24 37.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 -164.3 155.13 13.31 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.336 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.531 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 18.2 Cg_endo -58.02 148.36 77.42 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.381 2.054 . . . . 0.0 112.92 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.81 103.39 15.95 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.101 0.476 . . . . 0.0 111.862 -172.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.599 HD23 ' HG3' ' A' ' 21' ' ' ARG . 73.8 mt -66.27 141.19 58.11 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.981 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.22 -36.21 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.274 0.559 . . . . 0.0 110.413 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.4 m -71.88 -0.23 10.79 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.938 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 4.9 tp10 -97.14 -17.43 19.92 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.202 0.525 . . . . 0.0 110.592 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HA ' HG22 ' A' ' 61' ' ' VAL . 57.3 t -78.53 121.55 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.086 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.446 HG21 ' HG3' ' A' ' 62' ' ' GLU . 12.9 m -67.68 -56.42 9.41 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.826 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -139.8 162.62 34.7 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.064 0.459 . . . . 0.0 111.705 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -150.37 158.64 44.38 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.5 177.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.47 122.37 3.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 104.91 6.66 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.91 0.386 . . . . 0.0 110.998 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.575 HD22 ' O ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -131.42 91.82 3.07 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.321 1.057 . . . . 0.0 110.883 177.435 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -91.13 90.75 7.95 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.832 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.406 HD22 ' O ' ' A' ' 105' ' ' GLY . 54.0 mt 62.65 -170.46 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 173.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -154.73 -164.98 1.94 Allowed 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.4 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.68 -29.81 28.59 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -98.85 4.13 47.46 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.133 -0.354 . . . . 0.0 111.887 -174.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.406 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 78.92 9.31 87.22 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.576 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.7 t -121.92 134.55 24.74 Favored Pre-proline 0 CA--C 1.54 0.581 0 O-C-N 122.596 -0.355 . . . . 0.0 110.809 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.604 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.8 Cg_endo -62.04 100.98 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 121.959 1.773 . . . . 0.0 112.192 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -70.27 78.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.208 0.528 . . . . 0.0 112.346 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.429 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 9.8 mp -65.45 -18.54 65.39 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 176.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.85 -36.37 41.53 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 121.265 -0.493 . . . . 0.0 113.504 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -79.85 -34.83 39.03 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.999 0.428 . . . . 0.0 111.542 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -83.3 -25.69 31.31 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -172.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 mt -91.45 -64.42 1.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.436 0.636 . . . . 0.0 111.135 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -161.53 124.99 3.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.061 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.7 mt -48.88 94.81 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -171.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.32 174.652 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.677 0.275 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 63' ' ' ALA . 46.5 p -87.2 142.17 28.11 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 111.398 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 62' ' ' GLU . 88.0 mt -127.9 141.64 51.49 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.148 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 63' ' ' ALA . 23.0 pt -110.66 139.31 34.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.897 0.379 . . . . 0.0 111.19 177.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.416 ' HB3' HD11 ' A' ' 58' ' ' LEU . 66.0 m-85 -122.13 136.2 54.88 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.922 0.391 . . . . 0.0 111.631 -175.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.492 ' HD2' ' HG ' ' A' ' 36' ' ' LEU . 57.3 tttp -138.9 113.42 8.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.001 0.429 . . . . 0.0 111.158 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.3 mt -85.31 140.13 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.8 pt? -161.07 160.71 30.79 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.68 0.276 . . . . 0.0 110.914 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 t -70.23 151.42 45.37 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.786 0.327 . . . . 0.0 111.173 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.05 -28.35 66.37 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.786 0.327 . . . . 0.0 110.322 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.95 99.11 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.234 175.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -67.73 -46.9 70.85 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.248 0.547 . . . . 0.0 110.715 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 30.6 t-105 -60.27 -49.7 76.56 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.467 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.72 -30.72 71.78 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.46 86.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.313 0.577 . . . . 0.0 110.984 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.28 66.86 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.18 0.514 . . . . 0.0 111.371 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HA ' HG11 ' A' ' 90' ' ' VAL . 28.3 ttpp -67.3 -27.43 67.17 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.538 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -46.34 87.96 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.939 0.4 . . . . 0.0 111.272 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.437 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 24.4 pt20 -84.14 -19.86 33.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.432 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.2 -0.35 63.9 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 121.365 -0.445 . . . . 0.0 113.623 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 14.1 ptt180 -140.33 138.3 34.8 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.272 0.558 . . . . 0.0 112.141 -177.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -104.22 95.98 6.33 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.319 173.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -85.15 -1.93 57.45 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.219 0.533 . . . . 0.0 110.626 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.47 149.27 9.51 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.86 -0.609 . . . . 0.0 113.178 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.9 m -73.93 -179.56 3.79 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 122.626 -0.338 . . . . 0.0 110.294 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.91 -47.82 16.24 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -68.53 -55.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -54.74 -51.75 64.66 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.35 -36.76 83.22 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.53 -38.21 77.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.105 0.479 . . . . 0.0 111.472 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -78.49 -33.63 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.168 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.22 -5.92 84.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.241 -0.504 . . . . 0.0 112.207 -175.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 85' ' ' TYR . 31.6 m-85 -124.49 111.93 16.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.473 0.309 . . . . 0.0 110.506 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 64.8 mt -62.32 113.25 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 120.967 0.413 . . . . 0.0 111.199 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -104.21 123.87 48.1 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 112.076 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 3.8 mp -110.48 166.7 10.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.206 -179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.3 m -111.05 116.5 31.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.864 0.364 . . . . 0.0 110.799 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.72 131.35 34.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -175.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.19 -127.81 42.47 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.041 0.776 . . . . 0.0 115.041 170.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.49 -19.21 65.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.84 0.352 . . . . 0.0 111.845 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.54 -29.02 66.51 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 110.716 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.8 -44.39 81.38 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.124 0.487 . . . . 0.0 110.817 175.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -61.32 -41.05 96.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.077 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 31.7 tt0 -60.7 -49.94 75.49 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.696 0.284 . . . . 0.0 110.624 174.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.0 m -57.24 -35.61 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.023 0.44 . . . . 0.0 110.933 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.18 88.16 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.0 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.41 -9.96 57.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 116.31 -0.405 . . . . 0.0 112.018 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 44' ' ' GLU . 33.9 mmtp -90.17 -61.18 1.74 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.101 0.477 . . . . 0.0 111.834 177.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -110.16 -40.12 4.8 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.487 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 99.9 m-85 -96.79 16.94 17.75 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -169.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.17 141.33 41.89 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.056 0.455 . . . . 0.0 111.8 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.14 23.17 65.86 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 114.461 0.545 . . . . 0.0 114.461 175.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.487 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 74.3 mt-30 -98.85 144.61 27.86 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.429 0.615 . . . . 0.0 111.424 177.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.28 142.25 27.82 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.4 81.31 0.18 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.048 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.2 mt -114.36 151.96 32.21 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.15 0.5 . . . . 0.0 111.75 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 49.5 t -130.46 142.81 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.783 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.9 tp -111.39 104.63 13.09 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.944 0.402 . . . . 0.0 110.648 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD22 HG11 ' A' ' 93' ' ' VAL . 84.8 mt -79.9 108.38 13.43 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.913 0.387 . . . . 0.0 111.03 177.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.449 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -108.18 118.02 35.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.889 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.6 t -125.53 143.64 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.437 ' HA ' HD23 ' A' ' 3' ' ' LEU . 46.6 tt0 -72.53 125.36 27.24 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 110.839 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.547 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -82.01 37.61 0.49 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -176.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.81 117.23 39.83 Favored Pre-proline 0 CA--C 1.544 0.748 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -46.28 83.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.118 3.212 . . . . 0.0 114.596 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 66' ' ' LEU . 3.9 mp -54.03 -56.26 19.63 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.687 0.755 . . . . 0.0 109.869 171.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.24 -136.71 2.05 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.834 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 37.8 tt0 -93.51 5.87 50.14 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.297 0.57 . . . . 0.0 111.139 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -81.2 -45.76 15.85 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 tp -81.13 103.07 10.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.989 0.423 . . . . 0.0 110.912 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.654 ' HE3' ' HB2' ' A' ' 73' ' ' GLU . 35.9 ttpt -114.01 117.61 31.81 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.827 0.346 . . . . 0.0 111.912 -177.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -71.57 98.17 1.83 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.096 0.474 . . . . 0.0 109.827 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.654 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -98.53 129.88 45.1 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.23 84.15 6.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.076 0.465 . . . . 0.0 110.021 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.5 m -61.08 106.54 0.61 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -176.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 66.32 -75.51 0.05 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.46 0.704 . . . . 0.0 111.807 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.26 -159.11 33.84 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.774 177.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.84 39.76 2.43 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.344 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.434 ' HB1' ' CE2' ' A' ' 81' ' ' PHE . . . -91.08 108.22 19.72 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.56 -0.377 . . . . 0.0 111.413 -177.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -75.58 92.74 2.94 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.434 ' CE2' ' HB1' ' A' ' 79' ' ' ALA . 65.5 m-85 -117.51 109.45 41.91 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 120.912 0.387 . . . . 0.0 111.91 177.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.628 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 55.2 Cg_endo -68.9 122.43 9.34 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.695 2.263 . . . . 0.0 112.515 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -115.19 120.35 39.44 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.41 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.459 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 16.2 mt -88.62 120.15 29.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.059 0.457 . . . . 0.0 111.7 176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.434 ' HA ' ' HD1' ' A' ' 33' ' ' PHE . 4.4 m-85 -82.86 13.36 3.95 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.351 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -133.54 145.66 57.26 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.212 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -62.91 134.14 45.03 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.356 2.037 . . . . 0.0 111.845 171.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.3 tp -93.42 107.53 19.35 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.4 135.21 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.217 -0.302 . . . . 0.0 110.482 174.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 17' ' ' LYS . 18.9 m -60.53 -30.36 46.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.96 0.409 . . . . 0.0 111.874 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -63.94 -18.02 63.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.598 176.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -90.57 -19.84 23.29 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.634 -177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.463 HG11 HD22 ' A' ' 59' ' ' LEU . 58.9 t -61.99 115.73 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 120.647 0.261 . . . . 0.0 110.998 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.449 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 27.9 m -53.36 -45.38 69.14 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 95' ' ' ARG . 36.8 ttt180 -162.39 146.76 12.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.178 0.513 . . . . 0.0 112.021 174.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -101.78 95.47 6.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.535 0.683 . . . . 0.0 110.199 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -77.91 137.74 38.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.761 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -75.66 149.11 38.23 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.471 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 107' ' ' PRO . 29.5 tp -140.07 133.24 29.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -123.77 171.12 9.87 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.296 0.57 . . . . 0.0 111.861 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.72 149.55 27.19 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.742 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -96.64 -161.4 0.87 Allowed 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.099 0.476 . . . . 0.0 111.41 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.15 -23.57 67.16 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -94.04 -9.99 34.95 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.139 -0.351 . . . . 0.0 111.544 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.01 22.01 60.12 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.242 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.1 t -100.5 130.27 26.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 O-C-N 122.722 -0.281 . . . . 0.0 111.134 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.688 ' HB3' HD21 ' A' ' 99' ' ' LEU . 45.8 Cg_exo -57.72 104.94 0.18 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.369 2.046 . . . . 0.0 112.212 174.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -75.51 100.18 4.45 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.4 mp -100.09 -19.91 16.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.074 176.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.4 -44.85 28.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.245 -176.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -72.0 -30.48 65.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -34.48 72.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 178.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 25.1 mt -72.08 161.05 31.46 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.171 0.51 . . . . 0.0 111.934 -175.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -85.79 -43.38 13.37 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 78.4 mt -77.25 164.71 25.34 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 N--CA 1.469 0.521 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.085 178.048 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.586 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.651 0.263 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.4 t -154.54 169.36 24.0 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 80.7 mt -122.23 134.53 54.7 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.929 -174.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.496 HD12 HD13 ' A' ' 36' ' ' LEU . 18.5 pt -121.63 142.44 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 121.02 0.438 . . . . 0.0 111.217 176.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 78.9 m-85 -124.68 145.72 49.52 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.151 0.501 . . . . 0.0 112.263 -175.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 58.6 tttm -135.27 126.94 29.03 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.052 171.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 64.4 mt -93.67 135.62 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.651 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.534 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 pt? -156.47 173.46 16.87 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.627 0.251 . . . . 0.0 110.948 177.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.6 p -77.62 150.74 34.61 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.709 0.29 . . . . 0.0 110.702 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -56.37 -39.36 72.79 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.133 0.492 . . . . 0.0 111.081 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.3 95.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.073 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.59 -44.37 96.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.147 0.498 . . . . 0.0 110.839 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.444 ' CH2' HG13 ' A' ' 90' ' ' VAL . 26.5 t-105 -63.78 -63.81 1.06 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.248 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -29.44 67.65 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.19 -47.51 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.145 0.497 . . . . 0.0 111.095 174.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.9 -30.29 65.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.4 ttmt -56.11 -50.87 69.85 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.321 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.01 80.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.202 0.525 . . . . 0.0 111.358 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -72.44 -24.53 61.22 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.77 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.63 -11.59 13.34 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.261 -177.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -124.86 144.3 50.38 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.508 -0.407 . . . . 0.0 111.965 -176.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.684 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 63.3 t80 -149.19 111.18 4.6 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.067 0.46 . . . . 0.0 111.205 173.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.84 -4.0 44.5 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 122.181 -0.324 . . . . 0.0 111.84 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.63 -176.99 16.91 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.98 -0.628 . . . . 0.0 113.111 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.406 ' O ' HD23 ' A' ' 29' ' ' LEU . 91.4 p -100.3 178.9 4.63 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.759 -0.26 . . . . 0.0 110.356 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.8 -27.79 19.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.137 0.494 . . . . 0.0 111.156 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -68.59 -52.93 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.094 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -58.79 -40.46 84.1 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 25' ' ' SER . 4.5 mm? -65.89 -26.71 67.75 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.476 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.31 -47.07 52.69 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.804 0.335 . . . . 0.0 111.218 175.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -64.74 -34.27 77.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.178 0.514 . . . . 0.0 111.406 174.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 93.57 10.67 58.95 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.077 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -164.18 147.99 9.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.0 mt -64.74 109.09 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.064 0.459 . . . . 0.0 110.482 176.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -74.97 87.67 2.33 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.343 0.592 . . . . 0.0 111.802 -177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.496 HD13 HD12 ' A' ' 4' ' ' ILE . 80.5 mt -84.52 173.46 10.81 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.345 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.459 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 69.0 m -148.69 144.63 27.25 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.947 0.403 . . . . 0.0 111.238 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.5 163.13 28.12 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.342 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -45.55 -47.89 12.32 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.385 -0.436 . . . . 0.0 113.799 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.15 -51.79 55.78 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 5.0 mt-30 -74.67 -32.44 62.22 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.981 0.419 . . . . 0.0 111.358 -175.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.45 -49.56 74.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.16 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.495 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.2 tt0 -67.3 -41.07 85.98 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.377 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.19 -51.91 67.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.965 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -56.37 -38.83 71.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.315 0.579 . . . . 0.0 110.779 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -67.68 -27.68 67.05 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.688 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.34 -41.12 18.59 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -78.53 -42.26 29.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -105.52 -58.18 1.93 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -171.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.519 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 95.5 m-85 -91.11 12.69 19.14 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.51 119.73 12.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.045 0.45 . . . . 0.0 112.19 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.68 -0.49 65.18 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.756 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.506 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 65.7 mt-30 -92.97 116.06 28.7 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 117.158 0.479 . . . . 0.0 111.194 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.34 39.79 1.11 Allowed 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -132.36 17.54 4.45 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.744 0.307 . . . . 0.0 111.195 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.426 ' CD1' ' HB3' ' A' ' 50' ' ' PHE . 14.1 mt -94.54 124.54 38.64 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -171.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.422 ' O ' HD23 ' A' ' 8' ' ' LEU . 95.6 t -98.85 130.1 48.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.084 169.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.466 HD22 HD21 ' A' ' 99' ' ' LEU . 54.3 tp -97.87 109.37 22.14 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 110.672 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.9 mt -81.02 104.65 11.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.831 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -94.55 93.81 7.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.155 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.748 HG22 HG13 ' A' ' 93' ' ' VAL . 22.3 t -112.26 138.18 42.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.966 -176.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 39.3 mt-10 -83.77 156.11 22.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.778 0.323 . . . . 0.0 110.304 173.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.38 59.8 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.914 0.388 . . . . 0.0 111.222 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 3.8 mm-40 -64.79 -51.42 57.77 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.975 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 89.3 Cg_exo -49.86 -56.13 3.43 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.613 2.209 . . . . 0.0 113.97 177.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.648 HD22 HD11 ' A' ' 84' ' ' LEU . 3.2 pp -81.84 -1.12 46.45 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -175.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.23 -155.5 47.55 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.055 -0.593 . . . . 0.0 113.827 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -94.27 14.11 21.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.9 -17.08 64.73 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.062 0.458 . . . . 0.0 111.033 175.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.8 tp -72.46 125.43 27.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.797 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -102.51 121.43 42.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.737 0.303 . . . . 0.0 111.385 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -89.04 131.42 35.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -137.3 103.28 5.05 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.166 0.508 . . . . 0.0 111.845 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -82.47 79.34 8.94 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.053 0.454 . . . . 0.0 110.936 175.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.4 m -68.01 -21.07 65.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.031 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.6 143.52 50.97 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.659 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -51.74 105.14 0.2 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.497 -0.383 . . . . 0.0 113.558 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.83 -30.9 9.37 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.348 -0.454 . . . . 0.0 113.423 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -91.05 99.11 12.2 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.209 0.528 . . . . 0.0 111.674 -177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.499 ' HG2' ' HB2' ' A' ' 74' ' ' ALA . 20.2 mtm180 -91.01 101.26 14.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.532 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -90.86 114.81 62.67 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -173.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.84 131.33 12.13 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.528 2.152 . . . . 0.0 112.432 174.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -127.23 129.12 47.17 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.648 HD11 HD22 ' A' ' 66' ' ' LEU . 7.1 mt -106.09 111.57 24.25 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.412 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -83.53 10.78 8.21 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.725 0.298 . . . . 0.0 111.637 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 86' ' ' ARG . 10.6 ptm180 -137.77 147.61 57.62 Favored Pre-proline 0 N--CA 1.472 0.638 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -176.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.72 135.16 65.3 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.883 2.389 . . . . 0.0 113.519 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.0 tp -94.39 131.75 39.73 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -89.56 136.15 33.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.759 0.314 . . . . 0.0 110.817 177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.537 HG21 ' HA ' ' A' ' 17' ' ' LYS . 95.2 t -57.4 -34.37 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 121.263 0.554 . . . . 0.0 110.83 176.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 59.1 p -67.72 -13.49 62.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.945 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -90.4 -21.42 21.96 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 120.901 0.381 . . . . 0.0 111.396 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.748 HG13 HG22 ' A' ' 61' ' ' VAL . 85.4 t -64.79 145.31 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 72.1 m -85.47 -68.68 0.71 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 74.3 ttt180 -126.17 146.75 49.83 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -110.28 124.78 52.26 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.048 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -139.96 108.19 5.79 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.02 128.96 38.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.818 0.342 . . . . 0.0 110.26 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.466 HD21 HD22 ' A' ' 58' ' ' LEU . 86.8 mt -78.19 90.63 4.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -174.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -78.49 99.94 6.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.156 0.503 . . . . 0.0 110.493 170.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.74 150.82 28.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.189 0.519 . . . . 0.0 111.928 -178.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -138.38 171.22 14.7 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.906 -170.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.56 -83.5 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 177.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -90.65 -11.75 38.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.042 0.448 . . . . 0.0 111.267 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.15 26.68 33.16 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.478 -175.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.73 126.21 36.2 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 122.356 0.262 . . . . 0.0 110.908 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.16 140.56 49.66 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.406 2.071 . . . . 0.0 112.853 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -84.11 87.77 7.16 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.347 0.594 . . . . 0.0 112.208 -175.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 43' ' ' GLN . 11.1 mp -93.96 -4.53 49.57 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.973 -0.454 . . . . 0.0 112.163 176.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.45 74.8 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.611 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 -28.93 61.36 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.324 0.583 . . . . 0.0 111.166 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -72.71 -46.08 55.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.132 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.9 mt -85.25 171.49 11.89 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -78.78 106.73 10.98 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.051 0.453 . . . . 0.0 111.632 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.8 tp -92.01 -40.55 11.03 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.812 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -173.548 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m -87.09 96.19 10.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -171.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.12 119.3 31.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.679 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HB ' HD13 ' A' ' 36' ' ' LEU . 26.6 pt -93.69 146.45 6.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 110.85 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.525 ' HB3' HD11 ' A' ' 58' ' ' LEU . 89.0 m-85 -126.14 133.67 51.54 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.121 0.486 . . . . 0.0 112.192 -174.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE3' ' CZ ' ' A' ' 22' ' ' PHE . 47.0 tttm -130.5 117.27 19.37 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.907 174.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pp -84.3 139.37 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.901 0.381 . . . . 0.0 111.21 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.504 ' HB3' ' HZ2' ' A' ' 6' ' ' LYS . 2.2 pt? -165.96 156.47 12.93 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.933 0.397 . . . . 0.0 111.682 177.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.9 m -69.83 140.1 53.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.613 175.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -49.98 -38.34 36.51 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.24 -46.32 62.29 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 176.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.9 -43.87 82.27 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.799 0.333 . . . . 0.0 111.177 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.531 ' CH2' HG23 ' A' ' 90' ' ' VAL . 28.1 t-105 -63.08 -53.14 58.33 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -28.5 69.72 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 122.394 -0.191 . . . . 0.0 111.485 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.68 -52.27 63.95 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.071 0.462 . . . . 0.0 110.777 173.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.97 78.79 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.141 0.496 . . . . 0.0 111.14 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -66.33 -38.03 86.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.11 84.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.172 0.51 . . . . 0.0 110.831 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -71.41 -27.95 63.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.428 0.633 . . . . 0.0 110.613 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.15 4.58 89.79 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.938 -173.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 89' ' ' LEU . 36.1 ttt180 -154.47 139.29 17.14 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -173.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.52 ' CZ ' ' HE3' ' A' ' 6' ' ' LYS . 83.8 t80 -122.44 140.31 52.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -154.85 74.34 0.92 Allowed 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.695 0.759 . . . . 0.0 111.763 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.26 117.17 1.14 Allowed Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.844 -0.616 . . . . 0.0 113.458 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.442 ' N ' ' HB2' ' A' ' 28' ' ' ASP . 70.1 m -70.43 -179.94 2.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 122.638 -0.331 . . . . 0.0 110.842 175.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -46.22 -49.9 16.54 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.211 0.529 . . . . 0.0 111.794 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.8 t -70.68 -51.74 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HB2' ' N ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -54.83 -53.17 58.77 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.839 0.456 . . . . 0.0 112.193 -178.144 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 45.8 tp -62.48 -36.64 83.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.949 0.404 . . . . 0.0 111.125 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -18.29 61.03 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.906 0.384 . . . . 0.0 111.888 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.03 -47.2 7.99 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.878 0.371 . . . . 0.0 111.573 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 150.0 -40.74 0.84 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.217 -0.516 . . . . 0.0 112.825 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -150.56 178.49 9.02 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.706 0.289 . . . . 0.0 111.199 -177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -85.83 125.04 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-O 121.011 0.434 . . . . 0.0 111.549 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -107.65 90.88 3.43 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.375 0.607 . . . . 0.0 111.334 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.625 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 80.9 mt -79.55 170.78 16.06 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.194 0.521 . . . . 0.0 111.805 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -132.23 119.37 20.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.63 101.81 8.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.68 -91.85 0.01 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.489 0.556 . . . . 0.0 114.489 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -45.95 -54.95 7.45 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.025 0.53 . . . . 0.0 111.699 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -63.73 -25.03 68.01 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.732 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.18 -54.6 9.19 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.635 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.418 ' NE2' ' HB2' ' A' ' 109' ' ' LEU . 9.6 tt0 -67.92 -30.81 70.22 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.684 0.278 . . . . 0.0 111.672 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.25 -46.46 77.04 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.627 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.1 m -60.38 -38.58 84.36 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.063 0.459 . . . . 0.0 110.837 175.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.316 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -77.23 -25.67 51.86 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.928 0.394 . . . . 0.0 111.567 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -82.42 -70.62 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.164 0.507 . . . . 0.0 112.237 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -88.02 -32.64 18.7 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.521 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 88.0 m-85 -101.13 14.36 32.22 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 2.4 tmt_? -58.39 101.91 0.1 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.356 0.598 . . . . 0.0 111.429 -177.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.69 21.72 30.55 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.294 176.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.521 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 76.5 mt-30 -90.94 -179.28 5.44 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.425 0.613 . . . . 0.0 111.438 173.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.5 160.03 35.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -176.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 61.98 31.07 18.14 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.287 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.3 mt -76.85 98.32 4.83 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.453 0.644 . . . . 0.0 111.207 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.462 ' O ' HD23 ' A' ' 8' ' ' LEU . 61.0 t -83.7 125.78 40.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.804 176.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 55.2 tp -94.01 101.62 13.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 174.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 91.5 mt -75.17 109.64 8.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.695 0.283 . . . . 0.0 111.194 178.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.27 114.45 28.74 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.563 176.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 93' ' ' VAL . 43.4 t -126.71 127.99 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.53 90.98 2.25 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.519 0.676 . . . . 0.0 111.16 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.69 42.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.307 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 65.7 158.89 0.13 Allowed Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.579 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.9 76.55 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.902 2.401 . . . . 0.0 112.918 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.4 mt -66.98 -65.23 0.71 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.72 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 145.46 -90.65 0.15 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 120.544 -0.836 . . . . 0.0 114.017 177.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -85.02 -42.57 14.74 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -173.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.456 ' HB2' ' HG2' ' A' ' 86' ' ' ARG . 24.7 p-10 -75.45 -41.97 54.43 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 111.805 -173.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.5 tp -85.96 96.49 9.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.219 0.533 . . . . 0.0 109.83 170.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 25.5 tptp -107.54 101.97 11.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.492 -171.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -78.27 103.3 8.12 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HG3' ' HG3' ' A' ' 71' ' ' LYS . 45.3 mt-10 -119.56 107.33 13.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.939 0.4 . . . . 0.0 111.707 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.632 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -77.16 133.57 38.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.345 175.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.1 m -69.3 173.21 5.97 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -51.39 90.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.543 0.687 . . . . 0.0 112.727 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 15.04 60.74 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.767 0.667 . . . . 0.0 114.767 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 165.66 167.74 26.75 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 119.795 -1.193 . . . . 0.0 114.958 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 61.36 97.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.907 0.883 . . . . 0.0 113.332 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 8.7 ptp180 -86.92 103.13 15.01 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.237 0.542 . . . . 0.0 111.199 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -90.28 120.6 69.1 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.002 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.625 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 20.3 Cg_exo -66.31 96.99 0.35 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.677 2.251 . . . . 0.0 111.959 173.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -90.53 112.9 24.75 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.952 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.444 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 56.8 tp -104.95 123.36 47.63 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.254 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -105.36 30.8 5.37 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.54 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' HB2' ' A' ' 69' ' ' ASP . 16.7 mmt85 -132.17 148.68 70.74 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 122.35 0.26 . . . . 0.0 111.554 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.85 123.25 7.82 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.562 2.175 . . . . 0.0 112.283 174.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 tp -90.55 108.53 19.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.008 0.432 . . . . 0.0 111.537 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 21' ' ' ARG . 4.1 mm? -69.26 142.34 54.17 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.74 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.531 HG23 ' CH2' ' A' ' 13' ' ' TRP . 4.4 p -57.08 -30.98 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.438 0.637 . . . . 0.0 110.942 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.2 t -62.92 -28.08 69.81 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.286 178.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 10.0 mm-40 -87.13 -2.81 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.434 ' HA ' HG22 ' A' ' 61' ' ' VAL . 92.5 t -77.82 128.15 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 120.813 0.34 . . . . 0.0 111.412 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 28.7 m -70.5 -61.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.812 0.339 . . . . 0.0 111.377 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.412 ' HD2' HH11 ' A' ' 95' ' ' ARG . 24.0 ttt85 -148.5 145.76 28.06 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.28 0.562 . . . . 0.0 111.924 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -111.2 105.58 14.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.874 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -87.67 90.25 8.3 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.941 -0.474 . . . . 0.0 111.837 -178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -71.92 110.09 6.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.896 0.379 . . . . 0.0 111.004 177.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.9 mt -130.64 106.05 8.23 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -72.1 139.87 48.6 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 166.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 105' ' ' GLY . 83.7 mt -78.96 160.29 27.3 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -152.51 165.74 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 63.42 -84.95 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.484 0.713 . . . . 0.0 112.028 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -106.07 -22.63 12.83 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.873 0.844 . . . . 0.0 109.619 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.559 ' O ' HD13 ' A' ' 101' ' ' LEU . . . 120.25 15.05 5.22 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.296 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.551 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 39.8 t -137.32 75.13 46.69 Favored Pre-proline 0 CA--C 1.547 0.862 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.411 ' HD2' HD22 ' A' ' 101' ' ' LEU . 2.9 Cg_endo -83.56 -73.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.482 2.121 . . . . 0.0 109.413 160.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.551 ' NE2' ' HA ' ' A' ' 106' ' ' VAL . 75.3 mt-30 56.07 -147.05 0.54 Allowed 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 161.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 109' ' ' LEU . 6.3 mp -64.78 5.65 0.3 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.97 -24.32 13.86 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.645 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -98.69 -28.61 13.45 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 120.993 0.425 . . . . 0.0 111.304 175.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -69.85 -36.77 75.81 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 109' ' ' LEU . 52.8 mt -104.97 166.16 10.57 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.894 0.378 . . . . 0.0 111.719 -175.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 63.83 24.91 13.91 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.277 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.752 HD23 ' H ' ' A' ' 115' ' ' LEU . 1.9 pt? -71.27 75.13 0.72 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.867 0.841 . . . . 0.0 111.853 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 N--CA 1.466 0.33 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.525 175.89 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.876 0.369 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m -87.97 106.3 18.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.879 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.45 116.28 22.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.003 0.43 . . . . 0.0 111.526 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 17.4 pt -105.77 129.23 59.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.196 0.522 . . . . 0.0 110.55 173.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.529 ' HB3' HD11 ' A' ' 58' ' ' LEU . 6.6 m-85 -110.75 159.22 17.83 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -168.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.525 ' HZ2' ' HG ' ' A' ' 36' ' ' LEU . 6.8 ttpm? -162.11 136.65 6.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.089 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -96.67 141.2 15.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.166 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -153.64 162.66 41.05 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.649 0.261 . . . . 0.0 110.812 174.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -73.69 149.34 41.97 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 19.5 mmm-85 -53.65 -40.44 65.86 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.319 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -23.9 59.95 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 111.831 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -89.32 -48.2 7.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 110.526 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 26.3 t-105 -65.17 -55.59 17.71 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.076 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -33.82 68.57 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.31 98.79 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.053 0.454 . . . . 0.0 110.617 173.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.66 93.85 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.414 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HA ' HG21 ' A' ' 90' ' ' VAL . 52.6 mtmt -63.66 -38.3 90.61 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.514 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.26 -40.99 78.8 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.158 0.504 . . . . 0.0 111.139 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -95.89 1.01 52.73 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.826 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.53 5.03 41.85 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 114.22 0.448 . . . . 0.0 114.22 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HG2' ' CD2' ' A' ' 89' ' ' LEU . 60.4 mtt85 -138.22 130.92 29.48 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.899 -0.765 . . . . 0.0 112.255 -175.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -95.25 111.38 23.24 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -102.81 -10.96 18.66 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -172.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.08 167.82 42.01 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.15 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.2 p -90.39 172.22 8.9 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 122.335 -0.509 . . . . 0.0 111.464 -177.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.37 -32.77 62.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.286 176.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.7 t -63.09 -45.06 99.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.069 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.502 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 7.7 m-20 -56.29 -51.45 68.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.906 0.384 . . . . 0.0 111.125 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.84 -35.48 80.1 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.997 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -35.36 72.2 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.136 0.494 . . . . 0.0 112.067 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.501 ' HB3' ' CE1' ' A' ' 35' ' ' HIS . 12.2 t70 -84.24 -55.65 4.07 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.397 -178.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.34 60.35 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 121.223 -0.513 . . . . 0.0 112.696 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 80.3 m-85 64.39 -171.91 0.18 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.522 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 65.8 mt -55.55 125.46 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -173.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.502 ' CE1' ' HA ' ' A' ' 28' ' ' ASP . 0.7 OUTLIER -87.68 146.59 25.63 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.823 178.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 5.1 mp -142.17 175.67 9.57 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.511 0.325 . . . . 0.0 110.156 167.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.5 m -140.52 159.55 41.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.043 0.449 . . . . 0.0 112.167 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.58 -174.35 3.81 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.531 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -51.36 -72.89 0.44 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.503 -0.379 . . . . 0.0 113.994 -177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -65.78 -32.45 73.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.027 0.442 . . . . 0.0 110.974 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -63.74 -29.51 70.71 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.03 -44.21 93.22 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.063 0.458 . . . . 0.0 110.917 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -66.71 -34.76 78.55 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.92 -52.08 66.58 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.101 0.477 . . . . 0.0 110.492 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 29.4 m -57.77 -38.96 76.36 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.017 0.437 . . . . 0.0 110.938 176.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.51 -50.07 68.83 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.882 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.04 -22.25 66.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -99.94 -43.23 6.46 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -109.78 -19.51 13.12 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -170.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.526 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 92.7 m-85 -131.81 28.48 4.54 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 122.021 -0.425 . . . . 0.0 112.041 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -71.62 119.12 15.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.849 0.357 . . . . 0.0 111.882 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.5 61.09 4.32 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-N 116.199 -0.455 . . . . 0.0 113.703 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.559 ' HB2' HD11 ' A' ' 56' ' ' LEU . 49.8 mt-30 -140.98 159.95 41.11 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 111.662 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.43 175.2 5.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.341 177.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 47.3 m-80 61.26 30.23 19.08 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.166 0.508 . . . . 0.0 111.172 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 53' ' ' GLN . 84.9 mt -92.96 127.23 38.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.39 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.51 122.54 60.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.815 0.34 . . . . 0.0 111.109 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 99' ' ' LEU . 43.7 tp -88.1 98.09 11.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.849 0.357 . . . . 0.0 110.253 174.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 93.9 mt -74.18 107.27 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.823 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.49 100.74 10.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.639 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 95.9 t -109.08 131.62 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.038 0.447 . . . . 0.0 112.155 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -73.55 123.18 23.46 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.779 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.17 -52.2 64.78 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.544 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 1.8 mp0 -59.98 -48.75 93.92 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.544 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 38.1 Cg_exo -62.95 -16.11 52.01 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.153 1.902 . . . . 0.0 113.716 176.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tt -64.79 -65.83 0.62 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.0 -137.04 5.97 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.659 -0.781 . . . . 0.0 114.058 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -103.68 -21.63 13.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -172.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -78.86 30.49 0.2 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -169.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 82' ' ' PRO . 58.6 tp -112.02 140.41 46.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.024 0.44 . . . . 0.0 111.748 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -150.86 128.12 11.27 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.358 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.577 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 76.6 m95 -76.98 86.05 3.5 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.416 0.626 . . . . 0.0 110.504 175.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.2 119.42 33.68 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.468 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.98 64.43 2.46 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.228 0.537 . . . . 0.0 110.89 176.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.9 p -77.74 74.15 4.3 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.07 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.46 HH11 ' HB2' ' A' ' 76' ' ' ARG . 3.1 mtm105 67.32 161.23 0.17 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.31 -63.36 3.97 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.19 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.63 150.09 5.2 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.193 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 68.06 -169.75 0.19 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.857 0.463 . . . . 0.0 111.791 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.577 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 4.4 mpt_? -104.86 122.67 46.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.241 0.543 . . . . 0.0 112.157 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -99.72 110.51 59.16 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.027 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.553 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 51.9 Cg_exo -55.89 111.43 0.77 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.668 2.245 . . . . 0.0 113.17 175.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -97.03 132.46 42.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.031 174.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.522 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 59.1 tp -107.91 111.7 23.94 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.937 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.14 30.04 0.28 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -173.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -160.35 154.13 19.19 Favored Pre-proline 0 N--CA 1.471 0.579 0 O-C-N 122.164 -0.335 . . . . 0.0 111.418 177.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.91 118.39 5.26 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.498 2.132 . . . . 0.0 112.331 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.6 tp -72.72 100.61 2.88 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.102 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.441 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 55.1 mt -58.9 130.06 45.16 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.506 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.543 HG21 ' HA ' ' A' ' 17' ' ' LYS . 96.0 t -56.54 -34.42 41.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 110.876 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.8 p -62.51 -26.75 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.88 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -87.11 -18.49 30.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -64.11 116.24 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.981 0.42 . . . . 0.0 111.254 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.639 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 51.0 p -70.99 -46.5 62.17 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -144.67 145.02 31.54 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -135.39 136.59 41.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.079 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.29 119.63 10.24 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.45 139.14 53.96 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.896 0.379 . . . . 0.0 110.808 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.677 HD21 ' HB2' ' A' ' 58' ' ' LEU . 3.5 mm? -89.02 105.9 18.08 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.54 90.64 6.79 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 168.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.729 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 70.9 mt -89.37 156.52 18.65 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -171.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -144.2 166.25 25.58 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.724 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 54.75 -86.41 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.498 0.719 . . . . 0.0 112.9 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -97.29 -7.36 32.28 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.441 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.729 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 69.63 43.73 66.74 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.609 -175.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.869 ' H ' ' HD2' ' A' ' 107' ' ' PRO . 71.4 t -156.08 -57.85 0.02 OUTLIER Pre-proline 0 N--CA 1.485 1.323 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.869 ' HD2' ' H ' ' A' ' 106' ' ' VAL . 7.4 Cg_endo -40.69 -74.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 124.462 3.442 . . . . 0.0 116.074 -164.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.412 ' H ' ' CD ' ' A' ' 108' ' ' GLN . 0.7 OUTLIER -48.69 71.5 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -172.084 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 107' ' ' PRO . 1.3 tp -102.06 -31.06 10.81 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.777 -0.577 . . . . 0.0 111.842 170.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.21 -47.1 34.42 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.05 -26.76 68.99 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.837 0.351 . . . . 0.0 111.658 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.25 -28.59 31.76 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.907 0.384 . . . . 0.0 110.965 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 41.0 mt -72.32 -70.16 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 173.87 -82.13 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.069 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.0 mt 55.4 25.18 7.36 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 . . . . . 0 N--CA 1.475 0.811 0 CA-C-O 121.296 0.57 . . . . 0.0 112.249 179.507 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.75 0.31 . . . . 0.0 111.607 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.7 p -123.92 138.12 54.52 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.281 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.497 HD21 ' HB1' ' A' ' 60' ' ' ALA . 2.3 tt -118.11 124.57 48.36 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 -173.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.403 HD12 HD22 ' A' ' 36' ' ' LEU . 28.9 pt -96.58 148.33 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.008 0.433 . . . . 0.0 111.219 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.482 ' HB3' HD11 ' A' ' 58' ' ' LEU . 88.2 m-85 -126.79 103.15 7.37 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -172.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 59' ' ' LEU . 23.2 tptp -89.97 109.5 20.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.832 0.348 . . . . 0.0 111.208 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.1 mt -88.86 137.01 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.214 175.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.506 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 1.7 pt? -166.11 171.13 12.71 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.992 0.425 . . . . 0.0 112.144 -177.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -80.95 148.12 29.96 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.74 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -58.13 -37.08 73.91 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.6 -21.94 65.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.758 0.313 . . . . 0.0 111.736 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HG2' ' HE1' ' A' ' 22' ' ' PHE . 41.6 tt0 -79.24 -51.71 9.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.532 0.682 . . . . 0.0 109.966 175.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.447 ' HB2' HD11 ' A' ' 8' ' ' LEU . 8.1 t-105 -64.01 -61.58 2.18 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.154 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.488 ' HA ' ' HB3' ' A' ' 17' ' ' LYS . 7.0 m-20 -60.69 -26.35 67.06 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.2 -44.45 83.87 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.127 0.489 . . . . 0.0 110.455 172.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.81 63.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.023 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.591 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.1 ttmt -66.02 -42.88 89.05 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.405 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.94 95.18 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.233 0.539 . . . . 0.0 110.753 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -65.91 -28.46 68.95 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.387 173.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.46 9.58 81.83 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.088 -171.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -150.93 112.25 4.38 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 122.609 -0.348 . . . . 0.0 111.673 -173.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.495 ' HB3' ' HB3' ' A' ' 88' ' ' LEU . 69.4 t80 -89.8 109.2 20.21 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.992 0.425 . . . . 0.0 110.688 175.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -93.97 -7.84 41.75 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.123 0.487 . . . . 0.0 111.129 -178.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.88 -177.7 19.39 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.922 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -104.63 -174.79 2.62 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 122.722 -0.281 . . . . 0.0 110.456 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.38 -43.79 61.99 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.98 0.419 . . . . 0.0 111.876 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.6 -40.85 82.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.865 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.61 -46.0 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.022 0.439 . . . . 0.0 110.919 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.51 -34.03 77.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.277 175.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.99 -44.02 97.61 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 111.027 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -69.48 -32.54 71.5 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.952 0.406 . . . . 0.0 111.136 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.31 -11.51 51.27 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.462 -0.399 . . . . 0.0 112.626 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -153.08 155.09 36.16 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.672 0.389 . . . . 0.0 110.731 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.0 mt -73.23 141.75 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.485 0.659 . . . . 0.0 112.233 -172.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -133.34 100.06 4.72 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.677 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 36' ' ' LEU . 4.8 mp -82.14 -32.74 29.93 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -171.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.2 m 73.22 165.14 0.29 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.885 0.474 . . . . 0.0 111.178 -174.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.37 131.26 20.32 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.08 -104.46 0.07 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 115.184 0.834 . . . . 0.0 115.184 171.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -48.59 -45.32 37.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.192 0.597 . . . . 0.0 111.67 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -68.33 -38.52 81.6 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.54 65.8 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.672 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.0 -39.19 94.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.87 -52.29 57.35 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.22 0.533 . . . . 0.0 110.593 177.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 m -58.68 -33.02 69.67 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.176 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.21 -48.55 81.0 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.778 0.323 . . . . 0.0 111.108 175.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -39.67 93.01 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.882 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -71.96 -43.79 64.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.994 0.426 . . . . 0.0 111.95 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -109.42 -66.05 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -172.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -76.23 -8.1 56.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -163.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -63.31 2.16 0.42 Allowed 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -173.412 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -149.07 40.05 0.91 Allowed Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -122.67 174.9 6.81 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.18 0.514 . . . . 0.0 111.67 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.26 161.49 17.14 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.276 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 59.8 36.8 22.12 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.206 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.402 HD12 HD21 ' A' ' 101' ' ' LEU . 89.2 mt -74.56 128.66 36.11 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.166 0.508 . . . . 0.0 111.904 -177.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.2 t -121.86 145.83 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.892 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 5' ' ' TYR . 47.2 tp -114.95 102.25 9.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.15 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 6' ' ' LYS . 90.4 mt -84.68 117.46 23.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.856 0.36 . . . . 0.0 111.414 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HB1' HD21 ' A' ' 3' ' ' LEU . . . -102.88 115.83 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.116 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 50.2 t -126.08 137.32 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 111.657 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -77.83 130.99 37.35 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.753 0.311 . . . . 0.0 110.62 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.61 -28.37 28.53 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.584 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 7.0 mp0 -63.82 -46.99 82.1 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -174.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 7.8 Cg_endo -49.04 -66.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.532 2.155 . . . . 0.0 113.796 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.501 HD23 ' H ' ' A' ' 66' ' ' LEU . 2.4 pt? -60.84 -26.97 67.73 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 58.81 -108.67 1.65 Allowed Glycine 0 CA--C 1.533 1.18 0 N-CA-C 115.104 0.802 . . . . 0.0 115.104 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.9 -27.74 66.97 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -170.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.44 ' HB3' ' HG2' ' A' ' 86' ' ' ARG . 79.0 m-20 -73.56 -7.16 50.77 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.1 tp -120.34 117.51 27.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.71 0.291 . . . . 0.0 110.245 174.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -133.45 134.05 43.08 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.14 0.495 . . . . 0.0 112.162 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -81.24 86.89 6.15 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.668 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -75.39 126.22 30.58 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.92 127.68 33.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.988 0.423 . . . . 0.0 111.358 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 87.3 p -74.11 176.64 6.37 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.396 0.617 . . . . 0.0 112.244 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -65.87 -30.05 70.59 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.972 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.96 14.27 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.779 176.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.55 -49.08 0.53 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.616 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.01 142.28 51.67 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -87.28 150.23 24.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.0 0.429 . . . . 0.0 111.728 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -130.48 124.74 21.25 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.268 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.98 99.5 0.4 Allowed 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.514 2.142 . . . . 0.0 112.357 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -98.25 125.13 43.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.447 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.1 tp -95.46 113.75 25.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.679 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -87.6 22.67 2.17 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.245 0.545 . . . . 0.0 111.824 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HG2' ' HB3' ' A' ' 69' ' ' ASP . 31.3 mmt180 -131.97 140.6 38.67 Favored Pre-proline 0 N--CA 1.468 0.44 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.678 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -59.28 118.0 4.82 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 121.921 1.747 . . . . 0.0 110.987 170.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 22' ' ' PHE . 56.4 tp -67.12 87.78 0.16 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.437 0.637 . . . . 0.0 111.578 -172.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.5 mt -60.22 134.18 56.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.591 HG21 ' HA ' ' A' ' 17' ' ' LYS . 79.3 t -60.09 -31.77 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 121.201 0.524 . . . . 0.0 110.695 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.1 m -71.04 -11.94 61.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.481 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.6 -13.79 22.65 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.955 0.407 . . . . 0.0 111.141 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t -76.53 137.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.861 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.688 HG22 ' HG3' ' A' ' 95' ' ' ARG . 22.8 m -76.3 -66.3 0.82 Allowed 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.688 ' HG3' HG22 ' A' ' 94' ' ' THR . 62.1 mtt85 -141.92 152.79 43.87 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.17 125.35 47.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.045 0.45 . . . . 0.0 109.959 171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.42 155.73 30.24 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.3 0.571 . . . . 0.0 112.537 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -98.7 96.1 7.69 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 1.8 pt? -79.24 149.19 31.95 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.334 0.588 . . . . 0.0 112.26 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -86.53 174.35 9.0 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.844 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.713 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 75.1 mt -133.91 86.51 2.29 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.688 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -90.3 166.19 13.46 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -174.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.14 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -135.01 26.95 3.57 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.341 0.591 . . . . 0.0 110.44 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.713 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 102.36 22.34 9.87 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.71 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.8 t -98.02 112.65 62.37 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 122.495 -0.415 . . . . 0.0 110.844 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 109' ' ' LEU . 32.4 Cg_exo -59.39 121.94 10.7 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.674 2.249 . . . . 0.0 112.85 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -74.59 75.82 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.523 0.677 . . . . 0.0 111.645 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.621 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.9 mp -73.23 -16.08 61.41 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.946 177.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.95 -36.48 51.16 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.039 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -71.58 -22.58 61.71 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.969 0.414 . . . . 0.0 111.498 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -90.6 -14.38 32.55 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 18.2 mt -98.32 -161.15 0.85 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.106 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 113' ' ' LEU . . . 76.82 -49.84 0.56 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.292 0.637 . . . . 0.0 112.101 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 tt 73.37 -61.89 0.49 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.44 0.696 . . . . 0.0 111.229 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 179.449 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 111.055 0.02 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.5 t 48.99 -177.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.2 mt -125.49 144.82 50.37 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.416 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.625 HG21 HD11 ' A' ' 70' ' ' LEU . 17.5 pt -118.71 139.88 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-O 121.158 0.504 . . . . 0.0 111.694 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.429 ' HB3' HD21 ' A' ' 58' ' ' LEU . 20.5 m-85 -124.66 147.46 48.53 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.635 -177.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.612 ' HZ3' ' HE2' ' A' ' 22' ' ' PHE . 87.8 tttt -143.7 119.6 10.62 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.794 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.0 mt -92.22 126.55 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 120.908 0.385 . . . . 0.0 110.884 175.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.436 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -143.37 168.19 20.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.598 -0.273 . . . . 0.0 110.979 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG3' ' A' ' 12' ' ' GLU . 29.0 t -71.25 145.34 49.65 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.977 0.418 . . . . 0.0 111.61 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 10' ' ' ARG . 25.5 tpt85 -56.84 -31.28 64.6 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.965 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.25 -47.2 74.52 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.356 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 43.4 mt-10 -60.07 -42.19 94.03 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.233 0.54 . . . . 0.0 110.893 177.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.511 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 20.0 t-105 -70.22 -36.49 74.6 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.582 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.26 -52.02 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.611 0.72 . . . . 0.0 110.465 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.72 -36.56 79.15 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.521 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.16 -46.89 88.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.957 0.408 . . . . 0.0 111.259 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.3 mttm -56.98 -41.56 78.6 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.632 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.9 -45.8 91.38 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.25 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -67.49 -26.44 66.36 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.037 0.446 . . . . 0.0 111.287 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 90' ' ' VAL . . . 87.35 -2.34 86.5 Favored Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.716 -170.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ptt-85 -160.37 168.6 24.87 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.8 0.334 . . . . 0.0 111.325 -176.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.612 ' HE2' ' HZ3' ' A' ' 6' ' ' LYS . 36.6 t80 -136.12 99.65 4.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.252 0.549 . . . . 0.0 110.111 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -94.44 172.89 7.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.091 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -74.97 140.25 26.4 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.688 -175.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.4 m -81.23 167.27 19.78 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 122.789 -0.242 . . . . 0.0 110.422 174.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.93 -32.65 46.76 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.878 0.37 . . . . 0.0 111.252 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.46 -51.31 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.222 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.09 -51.0 63.26 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.47 -32.38 64.92 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.743 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.27 -44.87 51.05 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.987 0.422 . . . . 0.0 111.59 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.97 -34.27 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.19 0.519 . . . . 0.0 111.21 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 138.9 52.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.929 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 65.46 -168.2 0.21 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 122.917 0.487 . . . . 0.0 111.491 -175.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.5 mt -54.26 104.42 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 121.234 0.54 . . . . 0.0 112.117 -173.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -77.58 115.46 17.36 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.367 0.603 . . . . 0.0 111.757 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.518 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 65.1 mt -101.72 -170.27 1.8 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.814 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.8 p -141.31 156.2 45.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -94.63 -177.64 4.28 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.155 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.4 -78.77 0.1 OUTLIER Glycine 0 CA--C 1.53 1.03 0 N-CA-C 114.028 0.371 . . . . 0.0 114.028 -176.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -63.53 -28.48 69.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.202 -0.587 . . . . 0.0 111.651 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.87 -38.75 89.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.586 0.231 . . . . 0.0 111.562 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.25 -48.31 82.28 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.732 0.301 . . . . 0.0 110.948 175.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 17.7 tp60 -59.55 -51.3 70.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.726 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.683 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 11.7 tp10 -62.58 -52.23 64.2 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.216 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 49.8 m -58.62 -38.07 77.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.878 0.37 . . . . 0.0 111.073 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -61.73 -44.61 96.59 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.823 0.344 . . . . 0.0 111.334 176.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.94 -25.6 64.64 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.683 ' HE2' ' HG3' ' A' ' 44' ' ' GLU . 54.5 mttm -88.44 -51.88 5.48 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -105.48 -43.02 5.06 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -169.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.511 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.1 m-85 -85.06 -2.07 57.57 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -174.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.8 ptt85 -62.36 130.96 47.63 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.087 0.47 . . . . 0.0 111.58 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.39 -7.83 80.53 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.267 -0.492 . . . . 0.0 113.457 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.442 ' HB2' HD11 ' A' ' 56' ' ' LEU . 70.4 mt-30 -91.36 116.75 29.09 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.229 -0.571 . . . . 0.0 111.022 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.66 155.76 19.41 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.897 0.38 . . . . 0.0 111.391 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 63.37 73.0 0.46 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.47 0.652 . . . . 0.0 111.435 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 53' ' ' GLN . 97.1 mt -120.76 154.3 35.85 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.804 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.1 t -128.78 138.74 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.939 0.4 . . . . 0.0 111.257 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 5' ' ' TYR . 5.9 tt -112.95 108.69 17.71 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.973 0.416 . . . . 0.0 109.941 176.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.15 110.98 17.17 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.205 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.444 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.83 117.38 34.22 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.51 130.88 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 120.96 0.409 . . . . 0.0 111.667 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.17 108.52 14.89 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.053 0.454 . . . . 0.0 110.848 176.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.83 52.94 2.61 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -169.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.526 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 44.5 mt-10 -80.92 -58.32 0.53 Allowed Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.914 -0.491 . . . . 0.0 111.975 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 83.1 Cg_endo -76.68 -38.72 0.86 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 122.07 1.847 . . . . 0.0 113.338 -178.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.586 HD23 ' H ' ' A' ' 66' ' ' LEU . 2.5 pt? -98.57 21.66 10.95 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.185 0.517 . . . . 0.0 111.561 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.52 -11.14 40.11 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 115.0 0.76 . . . . 0.0 115.0 -174.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -121.5 4.69 10.16 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 117.753 0.777 . . . . 0.0 111.49 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.589 ' HB3' ' HD3' ' A' ' 86' ' ' ARG . 2.3 m-20 -80.45 -1.94 43.67 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 111.008 175.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.625 HD11 HG21 ' A' ' 4' ' ' ILE . 2.7 pt? -137.07 163.83 29.85 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.026 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -123.79 126.22 46.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.997 0.427 . . . . 0.0 111.92 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -80.29 82.73 6.28 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.174 0.512 . . . . 0.0 110.315 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -77.94 98.24 5.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.328 0.585 . . . . 0.0 112.178 -175.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -92.16 67.72 5.05 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.546 0.689 . . . . 0.0 110.006 172.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 79.8 p -129.37 -73.13 0.57 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.612 -176.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -70.27 102.38 2.11 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.773 0.32 . . . . 0.0 111.191 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.91 -19.4 41.16 Favored Glycine 0 CA--C 1.525 0.698 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.046 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.65 -33.74 4.85 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 121.279 -0.486 . . . . 0.0 113.987 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -77.72 169.46 18.26 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.113 0.483 . . . . 0.0 112.015 -178.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -83.28 110.19 17.89 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -115.26 105.71 52.12 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.518 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 44.7 Cg_endo -71.76 114.26 3.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.564 2.176 . . . . 0.0 112.694 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -108.74 118.6 37.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.879 175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.413 HD22 ' H ' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -90.94 116.07 28.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.069 0.462 . . . . 0.0 110.43 178.688 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -87.14 9.32 20.31 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.023 0.44 . . . . 0.0 111.771 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 69' ' ' ASP . 35.1 mtp85 -129.52 149.41 72.79 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.065 -176.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.62 132.14 28.04 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.635 2.224 . . . . 0.0 112.701 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 93' ' ' VAL . 10.1 tt -89.6 106.32 18.38 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.9 mt -74.46 138.55 43.31 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.256 -0.277 . . . . 0.0 110.369 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 20' ' ' GLY . 26.2 m -61.19 -31.46 50.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.862 -0.524 . . . . 0.0 111.763 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 84.9 p -67.47 -12.28 59.92 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.67 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -90.65 -21.57 21.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.578 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 88' ' ' LEU . 48.7 t -62.21 118.15 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.694 0.283 . . . . 0.0 111.687 -176.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 87.8 m -58.45 -56.38 22.9 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.017 0.437 . . . . 0.0 111.125 177.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -145.0 144.63 31.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.219 0.533 . . . . 0.0 111.483 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -116.5 103.53 10.51 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.39 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -91.03 107.39 19.17 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.761 0.315 . . . . 0.0 111.827 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.65 111.35 4.74 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.08 119.33 9.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.471 0.653 . . . . 0.0 112.43 -173.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -71.73 -42.17 67.62 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.614 -176.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.4 mt 68.27 132.79 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.246 0.618 . . . . 0.0 111.836 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -140.09 162.29 35.59 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.272 0.558 . . . . 0.0 111.896 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.19 -79.82 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -105.21 11.97 32.44 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -171.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 71.89 30.08 66.3 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.026 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.78 142.3 26.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.123 0.569 . . . . 0.0 109.999 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.441 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 13.0 Cg_exo -71.99 103.72 1.53 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 122.13 1.887 . . . . 0.0 112.68 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -80.88 80.83 7.28 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.16 0.505 . . . . 0.0 111.643 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.9 mp -66.11 -26.67 67.56 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 122.048 -0.408 . . . . 0.0 110.864 174.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.28 -23.05 46.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.338 -0.458 . . . . 0.0 113.333 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -98.76 -11.73 21.61 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 122.463 -0.433 . . . . 0.0 111.584 175.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -88.8 -37.95 15.02 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.808 0.337 . . . . 0.0 111.502 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 14.0 mt -86.89 -172.15 3.85 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.301 -175.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.05 71.93 1.63 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.852 0.358 . . . . 0.0 111.854 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.1 mt 57.1 -88.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.179 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 121.312 0.577 . . . . 0.0 112.216 177.5 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p -96.13 145.83 25.17 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.97 123.54 46.06 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.864 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.619 HD12 HD13 ' A' ' 36' ' ' LEU . 13.1 pt -108.71 153.75 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -177.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 94.9 m-85 -131.85 163.11 28.99 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.583 0.706 . . . . 0.0 112.536 -176.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HZ3' HD23 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -157.95 115.56 3.0 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 177.198 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.5 mt -102.38 127.43 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.613 0.244 . . . . 0.0 111.339 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.444 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -151.92 166.0 32.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.916 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 m -69.46 146.71 51.74 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 122.3 -0.25 . . . . 0.0 111.67 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -57.25 -52.2 66.3 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.46 -39.76 64.73 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.162 0.506 . . . . 0.0 111.409 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -67.11 -36.33 81.69 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.847 177.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -64.28 -48.49 75.48 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.221 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.28 -30.22 69.32 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.53 0.205 . . . . 0.0 111.375 176.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.05 -60.19 3.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.989 0.423 . . . . 0.0 110.882 174.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.21 -35.22 69.37 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 111.266 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HA ' HG21 ' A' ' 90' ' ' VAL . 26.5 ttpp -69.92 -31.87 69.87 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.395 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.87 -21.7 61.62 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.303 0.573 . . . . 0.0 111.037 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -87.74 -23.13 24.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.971 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.95 -2.74 63.64 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 121.275 -0.488 . . . . 0.0 112.117 -172.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.568 ' HG3' HD23 ' A' ' 89' ' ' LEU . 54.0 ttp180 -143.13 141.53 31.23 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.006 0.431 . . . . 0.0 111.663 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -110.16 109.67 20.27 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.627 176.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -122.56 90.33 3.28 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.615 0.721 . . . . 0.0 112.226 179.057 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA2' ' HB2' ' A' ' 28' ' ' ASP . . . 65.98 101.62 0.02 OUTLIER Glycine 0 CA--C 1.533 1.194 0 N-CA-C 115.671 1.028 . . . . 0.0 115.671 171.311 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.2 m -76.75 177.9 7.22 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 167.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.06 -46.45 33.5 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.112 0.482 . . . . 0.0 112.294 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.0 t -70.06 -44.59 78.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.739 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HA2' ' A' ' 24' ' ' GLY . 5.2 m-20 -64.35 -27.5 69.06 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.87 0.367 . . . . 0.0 111.481 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.48 -36.3 73.77 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.312 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.16 -49.0 77.6 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.741 172.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.04 -28.17 69.4 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.623 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.82 -45.96 3.09 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -175.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -116.68 145.26 43.56 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -52.8 114.67 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -176.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -90.45 107.96 19.48 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.813 0.816 . . . . 0.0 110.532 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.684 HD23 ' HZ3' ' A' ' 6' ' ' LYS . 35.0 mt -89.45 54.88 3.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.522 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -45.87 107.12 0.09 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.897 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -103.31 147.05 27.56 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.6 -113.43 3.08 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 115.541 -0.754 . . . . 0.0 114.667 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -54.89 -47.67 74.02 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -59.81 -39.97 86.84 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.757 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.36 -56.55 19.09 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.939 0.399 . . . . 0.0 111.445 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -61.74 -49.7 75.36 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.8 -22.38 66.98 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -176.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.0 m -81.0 -40.5 24.22 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.21 0.529 . . . . 0.0 110.311 171.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.57 74.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.278 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.58 -24.57 67.62 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -100.31 -56.54 2.33 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.129 0.49 . . . . 0.0 111.971 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -78.6 -37.72 41.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -109.25 8.85 25.9 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -172.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.25 136.62 58.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.979 0.419 . . . . 0.0 111.654 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.66 -26.02 16.14 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.404 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -85.82 116.23 23.95 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 122.534 -0.392 . . . . 0.0 111.424 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB1' ' HA ' ' A' ' 100' ' ' ASP . . . -103.89 -0.46 29.05 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -92.03 15.78 12.59 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.65 159.08 18.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -177.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.7 143.34 38.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.988 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.0 tt -98.68 133.57 42.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.796 0.331 . . . . 0.0 110.967 175.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.4 mt -104.94 130.01 53.21 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.322 0.249 . . . . 0.0 110.975 177.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -118.84 122.19 41.78 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.721 0.296 . . . . 0.0 110.915 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.2 t -133.84 137.88 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.735 0.302 . . . . 0.0 111.562 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -77.19 127.65 32.99 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 170.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -52.36 64.12 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -175.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.481 ' HG3' ' HD2' ' A' ' 65' ' ' PRO . 35.0 tt0 69.43 141.52 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.921 0 C-N-CA 122.885 0.474 . . . . 0.0 110.874 -173.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 24.4 Cg_endo -61.59 77.45 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.575 2.184 . . . . 0.0 112.65 177.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.4 mt -72.64 -59.38 2.75 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.661 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.78 -118.71 0.79 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.365 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -130.38 18.26 5.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 122.381 -0.482 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -79.37 -36.6 39.04 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.83 0.348 . . . . 0.0 111.554 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -81.55 101.82 10.21 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.254 0.549 . . . . 0.0 110.804 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HD3' ' CE1' ' A' ' 85' ' ' TYR . 48.9 mtpt -95.67 109.87 22.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.136 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.535 ' CZ3' ' HG3' ' A' ' 82' ' ' PRO . 78.1 m95 -74.25 73.38 1.8 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.717 0.77 . . . . 0.0 109.256 167.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -90.15 117.5 28.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.246 -169.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -86.71 132.8 33.77 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 176.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.2 t -145.52 178.89 7.79 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 62.97 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.903 0.481 . . . . 0.0 111.7 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.32 23.65 0.44 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.38 -158.64 26.98 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.982 -0.447 . . . . 0.0 111.982 -176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 62.87 111.42 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.253 0.549 . . . . 0.0 112.371 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 -82.16 93.4 7.05 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.938 0.399 . . . . 0.0 111.63 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -78.86 113.98 39.99 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.515 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 12.3 Cg_exo -69.61 88.31 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.464 2.109 . . . . 0.0 112.494 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -88.52 106.49 18.32 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.5 tp -92.05 122.65 34.75 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.05 0.453 . . . . 0.0 111.229 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 71' ' ' LYS . 2.0 m-85 -86.43 21.18 2.18 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.471 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 12.1 mtm180 -132.6 143.15 47.55 Favored Pre-proline 0 N--CA 1.473 0.709 0 O-C-N 122.048 -0.408 . . . . 0.0 111.278 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.41 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 21.9 Cg_exo -65.87 111.12 1.85 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.299 1.999 . . . . 0.0 111.447 172.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.45 114.12 10.23 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.802 -170.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.568 HD23 ' HG3' ' A' ' 21' ' ' ARG . 71.0 mt -73.26 142.28 47.24 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.745 0.307 . . . . 0.0 111.155 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.622 HG21 ' HA ' ' A' ' 17' ' ' LYS . 86.1 t -59.08 -31.39 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.304 0.573 . . . . 0.0 111.06 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.6 p -73.79 -10.83 60.08 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.17 176.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 89' ' ' LEU . 55.3 mt-10 -89.22 -18.31 27.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.852 0.358 . . . . 0.0 110.556 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.1 t -72.52 127.45 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.409 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 89.0 m -73.33 -65.22 0.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.1 ptt-85 -148.18 154.56 40.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.812 0.339 . . . . 0.0 111.767 -174.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.62 174.19 5.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.043 0.449 . . . . 0.0 110.768 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -152.72 98.17 2.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.808 0.337 . . . . 0.0 111.601 178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.08 136.56 39.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.511 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.506 ' N ' HD23 ' A' ' 99' ' ' LEU . 1.5 pt? -141.06 97.52 3.19 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.635 0.731 . . . . 0.0 112.172 -177.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.439 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t70 -84.64 127.93 34.34 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.498 173.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -155.28 -171.54 3.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.05 0.452 . . . . 0.0 111.932 -171.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -142.48 -168.07 2.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.755 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.18 -0.73 15.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -175.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -133.56 -31.79 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -54.25 -53.41 37.9 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 110.531 -1.027 . . . . 0.0 110.531 164.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' HD2' ' A' ' 107' ' ' PRO . 2.1 t 65.68 146.04 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 170.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.553 ' HD2' HG13 ' A' ' 106' ' ' VAL . 24.1 Cg_exo -33.31 99.37 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.25 0 C-N-CA 123.756 2.97 . . . . 0.0 114.613 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -76.26 78.66 3.04 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.609 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.5 mp -100.19 -16.89 17.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.3 -27.96 48.65 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.246 -0.502 . . . . 0.0 113.921 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.95 -9.79 33.01 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 38.5 m80 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 23.2 mt -81.66 158.41 24.3 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.017 0.437 . . . . 0.0 111.38 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -96.63 15.28 22.16 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.507 HD13 ' HB3' ' A' ' 113' ' ' LEU . 7.2 mp -80.16 97.93 7.1 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.066 0.46 . . . . 0.0 112.022 -176.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 . . . . . 0 N--CA 1.468 0.435 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.576 173.776 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.418 ' O ' ' HB ' ' A' ' 2' ' ' THR . 63.1 mtt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 120.435 0.16 . . . . 0.0 111.138 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.418 ' HB ' ' O ' ' A' ' 1' ' ' MET . 14.5 t 174.86 -169.91 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.558 0.343 . . . . 0.0 111.136 -179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 89.2 mt -115.64 122.54 45.91 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.878 0.37 . . . . 0.0 110.817 177.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 36' ' ' LEU . 23.6 pt -102.51 149.38 7.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.033 0.444 . . . . 0.0 111.458 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.443 ' HB3' HD11 ' A' ' 58' ' ' LEU . 80.3 m-85 -142.65 121.67 12.85 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.772 -174.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HD2' HD23 ' A' ' 36' ' ' LEU . 79.6 tttt -110.48 125.29 53.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.921 0.391 . . . . 0.0 110.896 176.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.461 HD11 HD21 ' A' ' 109' ' ' LEU . 65.9 mt -98.29 132.49 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.342 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.439 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.2 pt? -145.78 171.06 15.33 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.687 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.4 p -77.85 148.92 34.43 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.127 0.489 . . . . 0.0 111.324 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -56.72 -36.1 69.31 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.5 -49.03 75.9 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.3 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -70.0 -40.85 75.03 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.505 ' HZ2' ' HG2' ' A' ' 96' ' ' GLU . 41.3 t-105 -63.4 -40.01 96.06 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.509 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 4.7 t0 -62.93 -43.84 97.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.246 0.546 . . . . 0.0 110.039 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.08 -46.08 85.86 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.513 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.62 89.49 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.208 0.527 . . . . 0.0 111.07 175.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.509 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 25.5 ttpp -60.75 -44.14 97.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.984 175.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -38.4 89.89 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.196 0.522 . . . . 0.0 111.352 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -74.39 -29.13 61.41 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.442 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.1 5.05 89.11 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.736 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.418 HH21 ' CD ' ' A' ' 23' ' ' GLU . 57.2 mtp180 -146.28 134.9 22.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.791 0.436 . . . . 0.0 111.278 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -102.11 98.44 8.61 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.449 0.643 . . . . 0.0 110.008 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.418 ' CD ' HH21 ' A' ' 21' ' ' ARG . 34.8 mm-40 -80.49 -176.05 5.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.23 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.12 116.81 8.86 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.176 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.4 p -74.21 -174.17 1.87 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.498 -0.413 . . . . 0.0 110.681 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.74 -37.21 65.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.01 0.433 . . . . 0.0 111.12 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.3 t -77.94 -47.22 25.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.11 0.481 . . . . 0.0 111.705 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.65 -43.1 99.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.174 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.63 -28.63 62.87 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.88 73.03 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.046 0.45 . . . . 0.0 110.909 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.51 -31.11 53.28 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.375 173.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.16 -12.45 48.59 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.365 -0.379 . . . . 0.0 112.531 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -141.55 151.51 43.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.997 0.519 . . . . 0.0 111.01 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.416 HG23 ' NZ ' ' A' ' 6' ' ' LYS . 55.1 mt -69.85 135.27 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -171.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -87.2 145.95 26.2 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.899 173.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.613 HD11 HD12 ' A' ' 84' ' ' LEU . 78.5 mt -134.64 -69.76 0.51 Allowed 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.552 ' OG ' ' HB2' ' A' ' 41' ' ' GLN . 39.9 t 76.89 165.25 0.25 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.484 0.714 . . . . 0.0 112.343 -175.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' ILE . . . -111.05 176.63 4.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.532 176.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.27 -44.19 7.68 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.441 0.536 . . . . 0.0 114.441 -177.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.06 -66.27 0.41 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.008 0.432 . . . . 0.0 111.929 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.552 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 20.8 mt-30 -76.11 -15.61 60.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -176.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.96 64.88 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.777 0.322 . . . . 0.0 110.686 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.568 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 12.4 tt0 -66.74 -35.73 80.8 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.217 175.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.646 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 63.7 mm-40 -55.21 -60.94 2.69 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.998 0.428 . . . . 0.0 110.724 173.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -54.71 -40.13 68.91 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.449 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -61.71 -41.04 97.08 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.466 176.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.85 -37.56 64.76 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.646 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 48.8 mttm -78.98 -61.52 1.99 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.02 0.438 . . . . 0.0 111.9 -178.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.55 -40.67 16.04 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -107.57 35.39 3.1 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 122.303 -0.248 . . . . 0.0 111.617 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -24.01 -51.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.711 1.204 . . . . 0.0 113.955 -174.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.53 50.14 0.46 Allowed Glycine 0 CA--C 1.525 0.695 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.731 177.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.564 ' HB2' HD21 ' A' ' 56' ' ' LEU . 77.6 mm-40 -77.46 124.74 28.3 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.544 -0.386 . . . . 0.0 111.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.46 68.25 4.85 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.128 0.489 . . . . 0.0 112.095 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -175.39 22.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.303 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 53' ' ' GLN . 42.1 mt -84.21 141.02 31.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.396 0.617 . . . . 0.0 112.288 -173.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.1 t -123.47 128.59 74.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.381 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.443 HD11 ' HB3' ' A' ' 5' ' ' TYR . 52.7 tp -95.82 114.03 25.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.299 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.2 mt -91.56 105.8 18.01 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.805 0.336 . . . . 0.0 110.96 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.69 112.73 24.66 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.479 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 93' ' ' VAL . 20.7 t -130.59 137.36 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.949 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.83 133.74 39.26 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 173.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.37 -74.09 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 59.18 161.52 0.09 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -59.73 -62.13 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.119 1.879 . . . . 0.0 112.182 169.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.3 pp 34.61 33.71 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.98 121.42 4.91 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.849 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.83 -1.12 0.56 Allowed 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -61.02 -25.43 66.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.761 0.315 . . . . 0.0 111.329 174.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.79 106.14 16.81 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.911 0.386 . . . . 0.0 110.295 174.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 73' ' ' GLU . 78.3 tttt -125.86 128.39 47.55 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -174.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 75.0 m95 -79.38 105.6 10.81 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.213 -0.304 . . . . 0.0 111.238 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG2' ' HE2' ' A' ' 71' ' ' LYS . 44.3 mt-10 -118.46 131.08 56.27 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 111.784 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.457 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -94.26 115.68 27.96 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.2 t -75.89 173.61 10.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.24 0.543 . . . . 0.0 112.168 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -64.94 98.03 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.476 0.655 . . . . 0.0 111.599 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 147.49 -33.13 1.33 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.134 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.23 -28.23 3.67 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.45 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -57.73 123.98 17.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.457 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 68.4 mtm180 -97.6 96.85 8.57 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.279 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 68.3 m-85 -104.95 112.81 65.26 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 27.9 Cg_endo -64.16 108.3 0.94 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.079 1.853 . . . . 0.0 111.748 173.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -90.47 126.15 35.81 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.348 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -96.45 112.69 24.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.419 178.46 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -78.69 3.29 16.87 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 120.794 0.331 . . . . 0.0 111.616 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.431 ' HB3' HD22 ' A' ' 84' ' ' LEU . 7.1 tpp180 -119.29 140.1 28.54 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 122.929 0.492 . . . . 0.0 110.635 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -53.19 139.08 63.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.45 2.1 . . . . 0.0 112.484 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.407 HD12 HD21 ' A' ' 36' ' ' LEU . 6.0 tt -88.81 107.11 18.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.188 0.518 . . . . 0.0 111.049 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.547 ' HB2' ' HG2' ' A' ' 92' ' ' GLU . 50.8 mt -79.35 130.79 35.78 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.54 -22.88 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 O-C-N 121.845 -0.534 . . . . 0.0 111.808 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 58.6 m -66.97 -15.97 64.05 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.532 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.547 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 51.4 mm-40 -81.51 -18.32 45.51 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.546 ' HA ' HG22 ' A' ' 61' ' ' VAL . 59.6 t -70.87 117.96 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 120.961 0.41 . . . . 0.0 111.879 -176.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.5 m -60.8 -46.95 88.5 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.966 0.413 . . . . 0.0 111.33 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -159.19 148.52 18.57 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.748 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.505 ' HG2' ' HZ2' ' A' ' 13' ' ' TRP . 0.4 OUTLIER -134.02 154.84 50.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.657 0.265 . . . . 0.0 111.14 177.719 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -166.82 150.05 6.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.878 0.37 . . . . 0.0 111.737 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -66.27 123.73 20.75 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.552 HD21 HD11 ' A' ' 109' ' ' LEU . 54.2 tp -78.31 128.55 33.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.585 -174.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -92.26 156.34 17.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.971 0.415 . . . . 0.0 111.306 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 73.7 mt -100.31 174.69 6.01 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.241 0.543 . . . . 0.0 112.016 -175.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.481 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 31.4 t70 -100.95 173.27 6.56 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.346 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.07 -33.16 37.97 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.948 0.404 . . . . 0.0 111.601 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.83 -28.98 24.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.254 0.549 . . . . 0.0 110.633 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.04 -23.78 6.46 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.605 -174.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.3 t -59.24 119.21 36.93 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.448 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 33.9 Cg_exo -59.19 111.32 0.88 Allowed 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 122.538 2.159 . . . . 0.0 112.817 177.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.481 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 85.2 mm-40 -88.79 84.86 6.68 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.299 0.571 . . . . 0.0 112.355 -175.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 43' ' ' GLN . 7.5 mp -81.94 -35.64 28.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.495 177.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.76 -34.73 29.62 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.949 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.47 -33.38 21.87 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.876 0.369 . . . . 0.0 111.415 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.65 -27.13 65.72 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 48.9 mt -94.03 179.71 5.24 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.196 0.522 . . . . 0.0 112.108 -175.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -78.57 71.15 5.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.988 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.3 tp -80.5 78.8 7.19 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.26 0.552 . . . . 0.0 110.631 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 121.272 0.558 . . . . 0.0 111.561 179.172 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 120.812 0.339 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 61.6 m -75.72 87.5 2.77 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.099 0.476 . . . . 0.0 111.14 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -76.75 111.83 12.69 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.9 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 36' ' ' LEU . 6.9 pt -96.32 135.14 31.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.08 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 71.7 m-85 -116.09 155.96 27.24 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -172.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 63.0 tttp -154.82 129.65 9.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.627 174.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.55 120.62 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 120.605 0.241 . . . . 0.0 110.931 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -135.49 158.48 44.26 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.838 0.351 . . . . 0.0 111.237 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 p -69.92 151.36 45.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.211 0.529 . . . . 0.0 112.088 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -58.81 -60.69 3.44 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.54 -33.79 64.12 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -69.41 -38.82 78.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.897 0.379 . . . . 0.0 111.088 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 44.1 t-105 -64.67 -46.48 82.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.812 0.339 . . . . 0.0 110.77 174.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.6 -37.06 84.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 176.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.528 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -61.76 -53.63 53.43 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.968 0.413 . . . . 0.0 110.828 175.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.32 -37.64 78.28 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.162 0.506 . . . . 0.0 111.311 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HA ' HG21 ' A' ' 90' ' ' VAL . 25.7 ttpp -67.42 -33.74 75.8 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.05 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.04 -36.43 79.91 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.267 0.556 . . . . 0.0 110.676 173.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 76.2 mm-40 -74.36 -29.45 61.57 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.0 175.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.79 2.97 74.62 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 115.993 -0.548 . . . . 0.0 112.587 -175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -154.19 129.0 9.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 111.62 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 65.1 t80 -95.92 97.9 9.99 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.172 0.51 . . . . 0.0 110.204 173.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.25 -36.67 71.85 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.132 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.44 157.7 7.66 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.533 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -84.47 170.05 13.89 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.396 0.279 . . . . 0.0 110.916 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.86 -43.8 69.84 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.074 0.464 . . . . 0.0 111.405 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.9 t -61.82 -32.37 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.503 176.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.527 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 71.1 m-20 -72.89 -49.89 27.05 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.943 0.401 . . . . 0.0 111.226 179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.43 -34.69 78.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.809 0.337 . . . . 0.0 111.618 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.52 78.6 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.083 0.468 . . . . 0.0 111.485 176.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.74 -38.93 37.65 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.008 0.432 . . . . 0.0 111.53 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.86 -20.55 28.98 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.887 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -129.59 160.23 33.91 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.685 0.394 . . . . 0.0 110.48 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.556 ' O ' HG22 ' A' ' 34' ' ' ILE . 32.7 mt -75.86 12.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 32.0 m-70 49.59 88.74 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.654 -0.654 . . . . 0.0 112.356 -178.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 4' ' ' ILE . 73.0 mt -117.45 155.88 28.93 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 122.156 -0.34 . . . . 0.0 110.628 176.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -141.9 149.03 39.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.67 -179.9 4.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.143 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -48.3 -63.3 3.76 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 121.463 -0.399 . . . . 0.0 114.054 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -55.6 -50.03 71.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.248 0.546 . . . . 0.0 111.674 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -60.89 -33.42 73.08 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.862 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.76 -44.74 66.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.012 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.48 -35.79 81.93 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.181 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.14 -56.87 11.78 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.895 0.378 . . . . 0.0 110.296 174.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 97.0 m -55.02 -31.62 61.2 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.274 176.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.83 -58.73 4.94 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.899 0.38 . . . . 0.0 111.176 175.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.81 69.01 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -87.54 -45.62 10.3 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -112.39 -52.11 2.8 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.587 ' HB3' HE22 ' A' ' 53' ' ' GLN . 97.1 m-85 -102.45 60.18 0.82 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.677 0.751 . . . . 0.0 111.521 -170.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -106.4 3.37 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.43 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -113.9 60.06 0.38 Allowed Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.916 171.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.587 HE22 ' HB3' ' A' ' 50' ' ' PHE . 6.8 mm-40 -73.69 110.07 7.7 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.9 -66.82 1.02 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -137.1 61.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.549 0.69 . . . . 0.0 110.902 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.416 HD21 ' OE1' ' A' ' 53' ' ' GLN . 0.9 OUTLIER -130.19 -179.96 5.54 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.171 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.9 t -134.86 147.37 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.98 0.419 . . . . 0.0 111.675 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 70.2 tp -101.32 108.88 20.63 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.657 174.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.8 mt -84.75 147.84 26.66 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.887 0.375 . . . . 0.0 111.701 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.529 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -141.39 131.48 24.73 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 176.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.7 t -136.59 141.7 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -74.44 120.49 20.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.723 0.409 . . . . 0.0 111.15 173.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.538 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.61 -35.09 53.15 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -56.91 -55.28 45.33 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -173.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.43 0.11 9.46 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.141 1.894 . . . . 0.0 114.301 -170.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.28 -49.82 68.07 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 122.14 -0.35 . . . . 0.0 111.72 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.3 42.01 0.48 Allowed Glycine 0 CA--C 1.525 0.697 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.701 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 55.65 20.41 3.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.544 ' HB3' ' HG3' ' A' ' 86' ' ' ARG . 8.8 m-20 -70.7 -16.07 62.76 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.983 0.42 . . . . 0.0 111.85 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 82' ' ' PRO . 39.4 tp -90.21 112.0 23.36 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.887 0.375 . . . . 0.0 110.929 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HD2' ' HB2' ' A' ' 73' ' ' GLU . 3.7 tmtp? -95.61 104.27 16.18 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.862 0.363 . . . . 0.0 110.904 -178.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -69.55 94.33 0.75 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 110.022 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.562 ' HB2' ' HD2' ' A' ' 71' ' ' LYS . 11.7 tp10 -122.27 138.39 54.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.773 -169.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -83.32 176.47 9.1 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.37 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.1 t -168.42 -171.58 1.5 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.161 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 76' ' ' ARG . 39.7 mtp85 -54.07 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 111.467 -179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 144.36 -16.98 2.08 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.489 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.22 -4.17 77.9 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.902 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -95.6 129.44 42.8 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.387 -0.478 . . . . 0.0 111.936 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 87.5 mtt180 -80.29 109.46 14.79 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.978 0.418 . . . . 0.0 111.3 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -98.58 139.06 20.87 Favored Pre-proline 0 C--O 1.239 0.528 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 176.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.536 ' HB2' HD11 ' A' ' 70' ' ' LEU . 28.8 Cg_endo -63.24 97.22 0.19 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.279 1.986 . . . . 0.0 112.126 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -91.14 104.94 17.45 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.053 0.454 . . . . 0.0 111.995 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.429 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 51.3 tp -97.46 122.5 40.58 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.726 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -106.26 16.88 24.26 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.209 0.528 . . . . 0.0 111.424 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HG3' ' HB3' ' A' ' 69' ' ' ASP . 18.7 mmm180 -112.03 130.78 22.91 Favored Pre-proline 0 N--CA 1.47 0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.83 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.29 116.32 2.88 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.658 2.239 . . . . 0.0 112.709 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 50.0 tp -74.13 95.26 2.54 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 121.072 0.463 . . . . 0.0 111.622 -175.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.3 mt -59.67 122.9 15.27 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.532 HG21 ' HA ' ' A' ' 17' ' ' LYS . 83.0 t -61.58 -34.1 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.875 0.369 . . . . 0.0 111.966 -176.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -72.74 0.32 11.15 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -118.56 -1.15 11.23 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.866 0.365 . . . . 0.0 111.302 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 90' ' ' VAL . 79.8 t -74.3 139.26 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 122.183 -0.323 . . . . 0.0 111.539 -179.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 37.0 m -69.36 -59.44 2.99 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 95' ' ' ARG . 1.9 mmp_? -147.07 151.1 36.33 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 8.0 pt-20 -129.92 95.91 4.07 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.891 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.56 132.07 44.27 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.99 149.92 41.02 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.68 171.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.511 ' N ' HD23 ' A' ' 99' ' ' LEU . 1.9 pt? -150.85 146.22 26.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.094 0.473 . . . . 0.0 112.091 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -127.71 -161.49 1.09 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.81 177.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.43 HD11 ' HA2' ' A' ' 52' ' ' GLY . 98.1 mt -117.22 135.74 53.57 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -143.72 -175.55 4.62 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.665 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.83 -78.19 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 177.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -139.13 17.92 2.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.651 0.739 . . . . 0.0 110.223 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 100.2 32.47 5.53 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.093 -173.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.6 t -116.95 132.2 23.56 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 122.52 0.328 . . . . 0.0 110.665 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -79.17 77.3 4.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.865 1.71 . . . . 0.0 111.163 171.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -70.07 83.72 0.51 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 122.733 1.254 . . . . 0.0 111.577 -174.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 6.39 0.27 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.256 -1.338 . . . . 0.0 113.216 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.32 -25.97 4.61 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.431 -0.414 . . . . 0.0 113.644 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.5 -36.65 84.87 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.596 0.713 . . . . 0.0 110.658 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -76.7 -23.91 53.12 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.335 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.66 160.76 14.95 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.917 0.389 . . . . 0.0 111.76 -174.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -91.83 -83.17 0.29 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.426 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 58.36 172.61 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 . . . . . 0 CA--C 1.547 0.846 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.042 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.4 mtm . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.8 p 54.97 128.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.2 mt -125.66 150.99 47.14 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.5 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -125.02 149.8 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 120.726 0.298 . . . . 0.0 110.757 174.179 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.421 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.1 m-85 -130.9 141.46 50.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 35' ' ' HIS . 24.9 ttmm -134.91 127.45 30.66 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.999 173.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.4 mp -101.3 130.74 50.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -154.94 166.27 34.08 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.789 177.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 57.4 p -78.46 143.15 36.95 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 122.185 -0.322 . . . . 0.0 110.381 178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' HB3' ' A' ' 13' ' ' TRP . 79.7 ttt180 -60.97 -25.2 66.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.0 -32.15 67.64 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.03 0.443 . . . . 0.0 111.288 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -89.51 -34.82 16.26 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.244 0.545 . . . . 0.0 110.982 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 15.8 t-105 -62.02 -53.92 48.8 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.885 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.59 -30.4 67.17 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.084 0.469 . . . . 0.0 110.191 172.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.7 -48.84 79.75 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.633 177.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HA ' HG21 ' A' ' 90' ' ' VAL . 56.7 mtmt -62.16 -30.9 71.37 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.58 -36.89 63.05 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.12 0.486 . . . . 0.0 110.976 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -71.66 -25.74 62.25 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.769 177.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 -15.69 53.71 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.206 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.548 ' NH2' ' HG2' ' A' ' 87' ' ' PRO . 49.4 ttt180 -140.03 147.2 40.02 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.115 0.483 . . . . 0.0 111.461 -177.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -116.46 88.05 2.81 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.793 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.73 -15.43 62.82 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.027 0.441 . . . . 0.0 111.313 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.69 175.49 13.95 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.993 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.6 p -75.3 -176.94 3.29 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 122.634 -0.333 . . . . 0.0 110.457 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.58 62.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.222 0.534 . . . . 0.0 110.637 172.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.3 t -78.04 -52.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.583 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -58.02 -42.32 85.05 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.925 0.393 . . . . 0.0 111.245 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.65 -35.16 74.94 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.338 179.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.0 -51.72 68.49 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 110.917 175.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.37 -34.9 76.88 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.138 0.494 . . . . 0.0 111.485 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.52 -40.42 2.59 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.394 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -98.17 117.91 33.6 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.488 0.315 . . . . 0.0 110.827 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.538 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 64.5 mt -64.78 122.42 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.413 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 47.4 m-70 -83.58 124.85 31.19 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.365 175.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.698 HD13 HG13 ' A' ' 4' ' ' ILE . 98.9 mt -113.35 -64.42 1.31 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.485 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 26.5 m 73.46 154.95 0.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.207 0.527 . . . . 0.0 111.85 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.08 -176.63 5.2 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.07 -64.73 3.91 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 114.285 0.474 . . . . 0.0 114.285 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 9.7 mp0 -56.54 -47.59 79.1 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 117.082 0.441 . . . . 0.0 111.117 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 29.9 mt-30 -57.09 -35.77 69.8 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.968 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.31 -48.87 60.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.871 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.689 ' HB2' HD22 ' A' ' 109' ' ' LEU . 28.9 tt0 -65.86 -34.95 79.33 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.365 -0.209 . . . . 0.0 111.488 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.1 mt-10 -64.42 -51.08 64.99 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 175.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 m -60.2 -40.31 89.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.248 0.547 . . . . 0.0 110.463 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.638 ' HB1' ' HG2' ' A' ' 51' ' ' ARG . . . -61.43 -47.41 85.86 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.709 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' HB2' HG11 ' A' ' 106' ' ' VAL . . . -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.315 0.578 . . . . 0.0 111.973 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.36 -41.81 14.2 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.684 -176.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.8 -6.04 13.86 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -166.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -144.71 -69.65 0.29 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.638 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.4 mmt180 -57.99 93.0 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.719 0.771 . . . . 0.0 112.918 -173.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.41 26.93 0.05 OUTLIER Glycine 0 CA--C 1.525 0.685 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.01 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -165.8 176.47 7.92 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.747 0.308 . . . . 0.0 111.627 -174.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.81 166.98 14.2 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' SER . 87.6 m-20 65.08 19.48 11.82 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 175.063 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.494 ' H ' HD13 ' A' ' 99' ' ' LEU . 65.1 mt -84.81 93.47 8.49 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.97 139.62 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.179 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.423 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 63.3 tp -107.4 99.92 9.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 74.2 mt -75.96 105.36 6.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.983 0.42 . . . . 0.0 111.027 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.21 102.6 12.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.767 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -105.2 139.82 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.802 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 94' ' ' THR . 4.2 mm-40 -79.29 115.33 18.88 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.554 0.216 . . . . 0.0 110.741 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.43 21.36 1.19 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.326 0.584 . . . . 0.0 111.192 177.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.59 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 32.6 tt0 -71.17 -41.1 10.21 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -176.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 11.7 Cg_endo -55.71 -67.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 121.742 1.628 . . . . 0.0 111.865 173.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.84 58.56 5.33 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 121.122 0.487 . . . . 0.0 112.278 171.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -98.43 -109.41 2.87 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.364 -0.446 . . . . 0.0 112.448 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 14.58 27.21 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.618 0.723 . . . . 0.0 110.558 173.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.568 ' HA ' HH11 ' A' ' 86' ' ' ARG . 0.8 OUTLIER -89.88 -69.54 0.71 Allowed 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.165 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.505 HD13 HD12 ' A' ' 36' ' ' LEU . 58.7 tp -100.29 134.54 43.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -176.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -124.39 128.34 48.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.756 0.312 . . . . 0.0 111.639 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -74.0 106.59 5.76 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.09 136.6 51.41 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -132.72 102.98 5.89 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -176.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 78.9 p -54.59 -48.28 72.33 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.154 0.502 . . . . 0.0 111.577 175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -80.38 5.57 14.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.402 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.72 -67.13 3.6 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.158 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.51 144.71 29.56 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.899 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 66.14 95.93 0.06 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.168 0.509 . . . . 0.0 111.19 -175.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.82 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 68.7 mtp180 -87.31 117.53 26.14 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.815 -172.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.409 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 65.4 m-85 -90.07 113.08 55.89 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 81' ' ' PHE . 19.5 Cg_endo -60.52 115.05 2.41 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.959 1.773 . . . . 0.0 112.052 174.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -115.63 136.88 52.62 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.933 0.397 . . . . 0.0 111.453 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.538 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 38.1 tp -98.44 107.13 19.52 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.099 0.476 . . . . 0.0 110.511 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -83.26 30.77 0.46 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -175.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.568 HH11 ' HA ' ' A' ' 69' ' ' ASP . 4.2 ptm180 -159.14 143.93 11.51 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 122.328 -0.232 . . . . 0.0 111.274 -177.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.548 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 13.9 Cg_endo -57.38 119.14 6.21 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.603 2.202 . . . . 0.0 112.945 177.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 tp -72.49 148.6 44.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.779 -174.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.495 HD23 ' HG3' ' A' ' 21' ' ' ARG . 42.9 mt -96.67 146.81 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 122.102 -0.374 . . . . 0.0 110.529 177.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.434 HG21 ' HA ' ' A' ' 17' ' ' LYS . 78.0 t -64.04 -39.74 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 O-C-N 122.05 -0.406 . . . . 0.0 111.427 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 t -72.17 -7.59 50.04 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.087 0.47 . . . . 0.0 111.1 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 26.6 tt0 -97.9 -7.3 30.51 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.408 0.623 . . . . 0.0 110.518 177.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.4 t -85.82 110.74 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.847 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.684 HG22 ' HD3' ' A' ' 95' ' ' ARG . 4.0 m -64.59 -67.91 0.4 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' A' ' 94' ' ' THR . 1.3 mpp_? -115.18 130.9 57.04 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 14.3 pt-20 -103.07 87.8 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.579 0.704 . . . . 0.0 109.641 169.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -85.23 140.2 31.06 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -171.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -83.58 157.37 22.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.134 0.492 . . . . 0.0 111.361 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.602 HD23 ' H ' ' A' ' 99' ' ' LEU . 2.7 pt? -85.64 119.29 25.81 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.498 0.666 . . . . 0.0 112.758 -176.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -114.18 94.36 4.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 166.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.587 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 65.5 mt -102.6 158.23 16.38 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -159.71 172.18 18.2 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.1 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.5 -82.91 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -117.59 8.67 12.93 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.113 0.482 . . . . 0.0 111.121 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 71.57 29.7 67.49 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.012 -174.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.847 ' H ' ' HD3' ' A' ' 107' ' ' PRO . 24.1 t -136.4 -22.1 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.453 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.847 ' HD3' ' H ' ' A' ' 106' ' ' VAL . 21.1 Cg_endo -90.25 50.2 1.03 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.697 1.598 . . . . 0.0 113.94 -163.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.621 ' NE2' ' HE ' ' A' ' 51' ' ' ARG . 0.4 OUTLIER -126.14 26.03 6.58 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -171.759 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.689 HD22 ' HB2' ' A' ' 43' ' ' GLN . 1.5 mp -100.65 -12.25 19.33 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.07 -9.17 46.55 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.389 177.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.23 -30.21 27.86 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.259 0.552 . . . . 0.0 111.198 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -100.56 -44.15 5.95 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.262 -172.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.28 -68.33 0.57 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.378 0.609 . . . . 0.0 111.051 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.176 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.462 ' N ' HD22 ' A' ' 115' ' ' LEU . 3.1 mm? -76.55 69.45 2.98 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.492 0.663 . . . . 0.0 110.323 179.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 . . . . . 0 CA--C 1.537 0.455 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.316 -174.611 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.537 0.208 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p -62.85 158.18 19.57 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.909 0.385 . . . . 0.0 111.538 174.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.63 144.08 29.13 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.069 0.461 . . . . 0.0 111.701 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.558 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 5.2 mt -107.14 146.0 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.405 178.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 34.3 m-85 -134.97 138.71 44.28 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -176.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 67.2 tttt -151.18 122.65 7.89 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.982 0.42 . . . . 0.0 111.372 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.533 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -94.29 135.78 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.126 -178.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.467 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -150.23 167.45 26.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.89 0.376 . . . . 0.0 111.093 178.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 t -71.1 149.34 46.57 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.728 0.299 . . . . 0.0 111.301 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.05 -38.91 71.25 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.875 0.369 . . . . 0.0 110.918 177.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.3 77.54 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.025 0.44 . . . . 0.0 111.699 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -69.7 -40.28 76.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.149 0.5 . . . . 0.0 111.164 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.495 ' NE1' ' HE3' ' A' ' 17' ' ' LYS . 22.1 t-105 -73.23 -46.13 51.97 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.891 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.16 -41.21 92.31 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.827 0.346 . . . . 0.0 110.965 176.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.36 82.03 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.165 0.507 . . . . 0.0 110.846 174.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 13' ' ' TRP . . . -59.01 -47.55 84.78 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.147 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HE3' ' NE1' ' A' ' 13' ' ' TRP . 96.2 mttt -60.06 -37.81 80.96 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.306 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.87 90.7 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.848 0.356 . . . . 0.0 111.807 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.47 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 28.6 pt20 -94.92 -3.02 49.41 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.804 0.335 . . . . 0.0 111.812 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.67 6.96 60.38 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.505 -0.379 . . . . 0.0 113.293 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 68.6 mtt180 -143.8 157.44 44.37 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 122.505 -0.409 . . . . 0.0 111.408 -175.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 23' ' ' GLU . 46.7 t80 -134.83 178.84 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 170.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 87' ' ' PRO . 67.3 mm-40 92.45 156.12 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.246 1.019 . . . . 0.0 113.703 172.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.04 42.52 24.38 Favored Glycine 0 CA--C 1.526 0.751 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.548 -170.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.1 p -81.56 -176.63 6.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.713 0.292 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.55 -51.01 61.73 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.701 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 36.2 t -69.88 -51.17 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -54.72 -44.17 73.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.864 0.364 . . . . 0.0 111.669 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.13 -35.23 69.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.04 90.02 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.901 0.381 . . . . 0.0 111.408 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -69.84 -39.3 76.51 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.983 0.42 . . . . 0.0 111.07 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 129.41 -25.07 4.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.123 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -159.04 161.44 36.55 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.685 0.394 . . . . 0.0 110.663 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 23' ' ' GLU . 66.0 mt -61.82 140.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.143 0.497 . . . . 0.0 112.312 -173.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -139.32 105.97 5.36 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.053 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 3.8 mp -98.21 -175.41 3.11 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.515 175.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.5 m -131.97 155.37 48.09 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.22 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.31 173.23 12.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.657 174.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.92 -57.41 11.06 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.667 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.05 -42.79 99.8 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.122 0.486 . . . . 0.0 111.505 178.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -74.29 -15.1 60.98 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.914 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -70.85 -49.77 42.52 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.093 0.473 . . . . 0.0 110.686 176.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -61.5 -36.99 82.06 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.089 0.471 . . . . 0.0 110.639 174.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.1 -47.18 85.78 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.143 0.497 . . . . 0.0 110.873 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 92.7 m -61.55 -31.23 71.25 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.059 0.457 . . . . 0.0 110.811 175.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.59 -58.43 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.812 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.61 -30.56 55.08 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.982 0.42 . . . . 0.0 112.12 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -84.69 -49.24 8.68 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -116.55 -35.4 4.25 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 98.5 m-85 -114.06 59.08 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.612 0.72 . . . . 0.0 110.728 -176.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -72.0 -4.66 29.89 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.25 -0.886 . . . . 0.0 112.797 -174.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.57 -96.76 0.1 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.56 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.0 mt-30 59.79 -164.08 0.22 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.613 0.365 . . . . 0.0 111.651 -176.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.63 120.49 30.9 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.858 -0.526 . . . . 0.0 111.7 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 57.5 83.12 0.11 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.01 0.524 . . . . 0.0 112.185 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 53' ' ' GLN . 79.6 mt -99.09 123.55 43.46 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.576 177.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.423 ' O ' HD23 ' A' ' 8' ' ' LEU . 48.4 t -87.73 127.62 40.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HB2' HD11 ' A' ' 99' ' ' LEU . 67.4 tp -99.6 99.77 10.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.274 174.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 89.0 mt -75.61 107.72 7.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.751 177.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.558 ' HA ' ' O ' ' A' ' 4' ' ' ILE . . . -117.29 114.05 23.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.601 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 94' ' ' THR . 43.5 t -127.0 142.53 43.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.487 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 0.7 OUTLIER -69.86 133.81 47.78 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.456 175.261 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.6 30.54 0.24 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -174.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.32 -41.59 2.41 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 122.039 -0.413 . . . . 0.0 111.772 174.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' A' ' 62' ' ' GLU . 18.2 Cg_exo -70.27 39.21 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.591 2.194 . . . . 0.0 112.405 168.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 70' ' ' LEU . 48.8 tp -61.68 -41.93 98.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.565 0.746 . . . . 0.0 112.394 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 60.71 -114.87 7.02 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.171 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.9 10.61 0.47 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.365 0.602 . . . . 0.0 110.966 175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -102.16 -26.18 13.45 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.494 ' HB3' HD12 ' A' ' 66' ' ' LEU . 38.6 tp -70.5 96.77 1.21 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.438 0.637 . . . . 0.0 110.291 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.585 ' HG2' ' HB2' ' A' ' 73' ' ' GLU . 39.1 ttmt -103.26 102.29 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.68 -175.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 45.7 m95 -70.42 98.14 1.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 71' ' ' LYS . 9.7 tp10 -137.9 159.9 40.76 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.716 -169.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.37 179.15 4.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.071 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 88.5 p -134.6 -68.76 0.53 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.036 0.446 . . . . 0.0 111.346 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -106.42 -66.8 0.98 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.77 -107.2 0.63 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.295 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.61 -163.45 10.21 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.928 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 69.7 143.87 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.426 0.631 . . . . 0.0 112.43 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.42 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 79.8 mtt180 -100.27 117.79 35.21 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.056 0.455 . . . . 0.0 111.747 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -97.96 129.76 30.32 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.447 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.487 ' HB2' HD11 ' A' ' 70' ' ' LEU . 37.8 Cg_endo -66.83 103.93 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.117 1.878 . . . . 0.0 112.533 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' LEU . 74.6 m80 -96.51 154.29 17.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.078 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.0 mt -129.74 145.93 51.52 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 112.358 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -114.12 10.19 17.35 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.836 171.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.421 ' HA ' ' HE ' ' A' ' 86' ' ' ARG . 1.4 mmp_? -118.43 133.97 23.48 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.238 177.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 23' ' ' GLU . 14.2 Cg_exo -68.51 136.81 37.61 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 121.601 1.534 . . . . 0.0 111.583 173.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.94 101.48 6.87 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.292 0.568 . . . . 0.0 111.707 -171.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.96 120.13 11.39 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.309 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.409 HG11 ' HG2' ' A' ' 17' ' ' LYS . 80.2 t -53.38 -36.14 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.067 0.46 . . . . 0.0 111.565 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.3 t -60.07 -30.43 69.21 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -79.76 -20.23 46.8 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.832 0.349 . . . . 0.0 111.49 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.7 124.94 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 120.683 0.278 . . . . 0.0 111.668 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.469 HG23 HG13 ' A' ' 61' ' ' VAL . 82.6 p -77.18 -57.72 3.68 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 60' ' ' ALA . 6.7 ptp85 -131.54 145.41 51.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.144 0.497 . . . . 0.0 112.113 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.416 ' CD ' ' HE1' ' A' ' 13' ' ' TRP . 8.1 pt-20 -122.36 97.73 5.6 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.145 0.498 . . . . 0.0 111.037 176.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -82.75 118.49 23.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 111.648 -176.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -84.32 105.86 15.48 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.094 0.473 . . . . 0.0 110.486 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 58' ' ' LEU . 73.2 mt -82.85 103.35 12.26 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.188 0.518 . . . . 0.0 112.386 -173.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -91.6 142.01 28.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.194 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.61 127.21 32.58 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -176.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -134.73 167.79 20.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.631 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.63 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 173.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -100.49 3.91 43.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.643 0.259 . . . . 0.0 111.664 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.51 22.55 72.56 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.136 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.9 t -123.14 136.34 26.88 Favored Pre-proline 0 N--CA 1.471 0.588 0 C-N-CA 123.248 0.619 . . . . 0.0 110.256 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 53.1 Cg_exo -54.35 117.68 4.2 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.676 2.251 . . . . 0.0 113.761 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -75.39 98.24 3.83 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.8 mp -100.43 -40.63 7.38 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.988 -0.445 . . . . 0.0 111.76 173.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.03 -42.9 31.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.617 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -89.56 -29.34 18.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -66.44 -33.3 75.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 59.8 mt -80.8 161.69 24.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.566 -178.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.92 -74.8 0.53 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.113 -176.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 56.2 tp 61.08 102.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.236 0.541 . . . . 0.0 111.4 -175.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 . . . . . 0 CA--C 1.537 0.447 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.374 -176.505 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.9 mtp . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.623 0.249 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.6 m -70.64 126.81 30.66 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.78 0.324 . . . . 0.0 111.817 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.8 mt -111.59 130.0 55.89 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.627 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.501 HG13 HD22 ' A' ' 36' ' ' LEU . 16.8 pt -114.32 132.22 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-O 121.335 0.588 . . . . 0.0 110.935 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.797 ' HB3' HD21 ' A' ' 58' ' ' LEU . 32.3 m-85 -107.6 135.2 49.45 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.015 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.597 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 50.0 tttm -120.8 124.23 44.55 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 122.355 -0.215 . . . . 0.0 111.207 175.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.2 mp -93.23 136.91 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.505 HD21 ' HG ' ' A' ' 59' ' ' LEU . 2.2 pt? -153.87 174.01 15.15 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.023 0.44 . . . . 0.0 111.622 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -85.87 150.65 24.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.971 0.415 . . . . 0.0 111.41 175.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -34.14 70.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.01 0.433 . . . . 0.0 110.248 177.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.89 -39.55 85.71 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.444 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.48 ' OE1' ' HB2' ' A' ' 25' ' ' SER . 52.7 mt-10 -62.45 -53.32 56.54 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.341 0.591 . . . . 0.0 110.908 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.411 ' CH2' HG13 ' A' ' 90' ' ' VAL . 47.0 t-105 -60.91 -60.36 3.91 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.612 -174.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.548 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -61.18 -31.59 71.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.357 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -65.4 -59.16 4.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.011 0.434 . . . . 0.0 110.67 174.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.7 69.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.993 0.425 . . . . 0.0 111.808 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HA ' HG21 ' A' ' 90' ' ' VAL . 37.2 ttpt -71.21 -26.69 63.05 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.931 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.56 -30.62 52.73 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.819 172.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 7.7 mm-40 -78.97 -29.63 44.01 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.934 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.52 -2.48 65.01 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.157 -0.474 . . . . 0.0 113.214 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 10.3 ptm180 -148.21 125.24 11.36 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 122.404 -0.468 . . . . 0.0 111.925 -174.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.597 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 53.6 t80 -93.84 116.96 29.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.04 0.448 . . . . 0.0 110.505 176.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -109.96 9.96 24.32 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -174.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.95 175.6 20.93 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.844 -0.693 . . . . 0.0 114.551 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.48 ' HB2' ' OE1' ' A' ' 12' ' ' GLU . 38.8 t -128.52 -175.81 3.63 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.006 0.522 . . . . 0.0 110.889 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.46 -33.02 63.26 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.405 HG12 ' CE1' ' A' ' 35' ' ' HIS . 41.3 t -70.76 -45.91 71.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.418 0.627 . . . . 0.0 111.051 177.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.515 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 14.7 m-20 -62.6 -38.6 90.8 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.898 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.55 -21.92 60.23 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.648 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.5 -39.98 85.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.053 0.454 . . . . 0.0 110.877 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.46 -59.4 2.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.368 0.604 . . . . 0.0 110.734 171.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 154.71 -49.32 0.49 Allowed Glycine 0 CA--C 1.525 0.68 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.737 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -128.93 169.43 14.65 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.607 0.363 . . . . 0.0 110.852 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.0 mt -54.59 134.06 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.824 0.345 . . . . 0.0 111.274 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.515 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 25.5 p80 -143.3 123.61 13.82 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.212 0.53 . . . . 0.0 111.761 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 6' ' ' LYS . 5.0 mp -96.58 -163.06 1.01 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.676 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' HB2' ' A' ' 41' ' ' GLN . 81.9 p -137.76 150.09 46.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.837 0.351 . . . . 0.0 111.327 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -98.91 109.53 22.27 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -176.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.78 -103.78 0.26 Allowed Glycine 0 CA--C 1.53 1.002 0 N-CA-C 114.579 0.592 . . . . 0.0 114.579 173.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.06 -42.01 84.55 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.788 0.328 . . . . 0.0 111.642 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 53.0 mt-30 -53.21 -28.71 28.24 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.017 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.48 -56.56 13.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.486 178.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -61.43 -43.04 99.57 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.373 178.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 18.8 mm-40 -55.55 -57.0 13.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.943 177.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 84.6 m -57.3 -38.46 74.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.942 0.401 . . . . 0.0 111.363 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.15 83.38 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.966 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.86 -24.65 28.47 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 67.1 mttm -88.87 -59.01 2.34 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -97.18 -33.87 11.33 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -170.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -98.75 64.47 1.48 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.506 0.669 . . . . 0.0 110.853 -173.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.438 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 4.5 mmp_? -109.36 139.14 44.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.804 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.24 39.85 93.06 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 114.959 0.744 . . . . 0.0 114.959 174.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.558 ' HB2' HD21 ' A' ' 56' ' ' LEU . 51.1 mt-30 -116.14 142.74 46.42 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 117.351 0.576 . . . . 0.0 111.116 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.49 127.63 32.44 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 58.95 84.1 0.11 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.429 177.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 53' ' ' GLN . 85.6 mt -101.65 134.96 43.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.274 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.8 t -113.09 152.96 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 110.928 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 5' ' ' TYR . 3.2 tt -129.2 114.88 16.85 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.008 0.433 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' HD21 ' A' ' 8' ' ' LEU . 86.5 mt -90.83 107.22 19.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.996 0.426 . . . . 0.0 110.873 177.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.523 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -95.87 107.37 19.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.505 177.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.23 143.91 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.014 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -72.27 127.97 34.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 122.096 -0.377 . . . . 0.0 110.604 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.15 -47.91 71.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.037 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 63.38 161.86 0.12 Allowed Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.79 -62.15 0.23 Allowed 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.485 2.123 . . . . 0.0 112.963 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 19.0 66.03 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -44.46 130.95 7.38 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 115.067 -0.969 . . . . 0.0 114.918 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 78.66 -24.67 0.21 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -69.0 -42.29 76.67 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.648 -0.657 . . . . 0.0 111.053 172.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.99 143.3 32.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 111.01 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -153.61 132.08 12.11 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.809 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 80' ' ' ARG . 93.0 m95 -77.84 64.05 3.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.701 0.762 . . . . 0.0 110.55 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -80.03 132.56 36.02 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.644 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -147.23 165.8 28.96 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.122 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 55.7 m -122.42 -178.08 3.8 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.779 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 75.18 -47.37 0.61 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 165.43 -34.42 0.25 Allowed Glycine 0 CA--C 1.524 0.624 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.689 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.22 -149.08 5.35 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.294 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 64.03 -175.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.124 0.488 . . . . 0.0 111.951 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.414 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 38.4 ptt180 -160.07 135.74 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.783 0.325 . . . . 0.0 111.369 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -131.21 123.21 19.57 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.64 95.06 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 121.942 1.761 . . . . 0.0 112.637 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -88.36 123.12 32.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.19 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -101.35 112.56 25.12 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.273 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -82.15 8.25 11.41 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -174.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -111.36 148.64 39.21 Favored Pre-proline 0 N--CA 1.473 0.689 0 O-C-N 122.034 -0.416 . . . . 0.0 110.904 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.66 109.47 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.022 1.815 . . . . 0.0 110.975 171.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.43 104.69 1.29 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.303 0.573 . . . . 0.0 110.825 -171.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.21 137.27 50.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.107 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.599 HG21 ' HA ' ' A' ' 17' ' ' LYS . 68.0 t -57.68 -34.73 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.8 m -69.46 -9.24 52.83 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.835 -0.621 . . . . 0.0 112.183 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -105.91 -6.99 18.44 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.926 0.393 . . . . 0.0 111.826 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 59' ' ' LEU . 58.7 t -69.74 110.46 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 122.024 -0.422 . . . . 0.0 111.233 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 85.1 m -48.81 -58.52 4.68 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -147.78 138.42 23.18 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.358 0.599 . . . . 0.0 112.104 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.89 118.88 35.46 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.442 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.97 108.45 12.95 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 122.025 -0.422 . . . . 0.0 111.969 -178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.0 126.59 31.23 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.234 0.54 . . . . 0.0 110.866 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -83.87 111.1 18.92 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -74.85 -11.72 60.21 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 177.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.3 mt 65.64 -167.43 0.21 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.693 0.397 . . . . 0.0 111.261 -176.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -149.05 -172.85 4.22 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 122.289 -0.257 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -28.49 65.42 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.68 -3.63 58.74 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.148 0.499 . . . . 0.0 110.649 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.11 -6.83 61.79 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 116.057 -0.519 . . . . 0.0 112.989 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.98 133.34 39.41 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.669 -0.312 . . . . 0.0 111.344 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.96 118.63 5.66 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.158 1.905 . . . . 0.0 112.354 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -66.3 97.99 0.44 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.34 0.59 . . . . 0.0 112.186 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.1 mp -100.17 -15.78 18.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.948 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -53.84 -33.39 49.61 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.759 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -68.54 -37.04 79.62 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 122.799 0.44 . . . . 0.0 111.652 174.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -85.45 -30.17 23.73 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -173.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.416 ' HB3' HD13 ' A' ' 115' ' ' LEU . 40.0 mt -89.95 169.34 11.3 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.74 8.08 43.48 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.871 0.367 . . . . 0.0 111.843 178.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.457 ' N ' HD12 ' A' ' 115' ' ' LEU . 6.4 mp -80.6 105.51 11.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.812 0.339 . . . . 0.0 111.327 -178.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 121.555 0.693 . . . . 0.0 111.717 -176.977 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 mtt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.71 0.291 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 63' ' ' ALA . 14.0 m -83.37 121.89 27.74 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -171.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 62' ' ' GLU . 0.4 OUTLIER -128.46 132.0 48.39 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.931 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.605 HD12 HD22 ' A' ' 36' ' ' LEU . 14.1 pt -114.16 145.76 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.542 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.9 m-85 -123.81 146.5 48.31 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.726 -176.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.54 ' HD3' ' HG ' ' A' ' 36' ' ' LEU . 6.4 ttpm? -156.35 125.28 5.99 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.252 -0.28 . . . . 0.0 111.433 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 55.6 mt -94.91 135.94 27.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 120.797 0.332 . . . . 0.0 111.808 -178.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.417 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -143.79 172.03 13.4 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.624 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.6 m -76.0 142.57 41.85 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.852 0.358 . . . . 0.0 111.587 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -55.94 -44.17 78.12 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.56 80.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.15 0.5 . . . . 0.0 112.127 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -69.42 -43.25 73.76 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.039 0.447 . . . . 0.0 110.95 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.6 t-105 -66.54 -34.75 78.6 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.628 177.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 24.4 t70 -60.04 -52.08 66.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.338 0.589 . . . . 0.0 110.432 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -55.32 -39.99 70.62 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.105 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 22' ' ' PHE . . . -59.82 -45.77 91.31 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.397 175.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.55 ' HA ' HG21 ' A' ' 90' ' ' VAL . 10.5 mtmp? -61.0 -36.0 78.33 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.859 0.361 . . . . 0.0 111.054 176.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -42.41 98.99 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.136 0.494 . . . . 0.0 111.129 174.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 77.0 mm-40 -70.74 -26.61 63.45 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.223 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.5 -1.51 61.1 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.406 -0.426 . . . . 0.0 112.405 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -150.77 134.57 16.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.099 0.56 . . . . 0.0 110.346 -173.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' ' HB1' ' A' ' 16' ' ' ALA . 90.1 t80 -134.9 130.25 35.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.85 0.357 . . . . 0.0 111.55 -176.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.677 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 1.7 pm0 -100.69 -75.19 0.59 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.294 175.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.677 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . -157.88 -123.62 0.75 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.717 -176.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.44 ' H ' ' HB3' ' A' ' 28' ' ' ASP . 23.2 t -175.69 -164.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.583 -0.363 . . . . 0.0 111.1 -173.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.89 -63.29 1.23 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' A' ' 30' ' ' ALA . 7.6 p -55.8 -40.33 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-O 121.119 0.485 . . . . 0.0 111.509 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -57.04 -54.68 44.02 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.426 177.274 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.09 -13.4 61.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' VAL . . . -66.04 -54.66 23.09 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.753 0.311 . . . . 0.0 110.614 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.42 -42.19 25.99 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.655 0.264 . . . . 0.0 111.229 174.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.42 13.42 7.51 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 170.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -148.41 139.27 23.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.852 0.826 . . . . 0.0 112.292 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mt -65.02 87.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.481 0.658 . . . . 0.0 111.157 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -93.29 112.07 23.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.605 HD22 HD12 ' A' ' 4' ' ' ILE . 4.8 mp -94.71 -160.65 0.79 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.667 176.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.5 p -142.88 153.03 42.73 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.867 0.365 . . . . 0.0 111.0 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.22 178.82 5.49 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.851 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.65 -67.56 2.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.035 -0.603 . . . . 0.0 113.653 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 3.3 mp0 -56.08 -42.77 77.22 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 122.642 -0.328 . . . . 0.0 111.12 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.503 ' NE2' ' HB1' ' A' ' 79' ' ' ALA . 82.8 mt-30 -56.56 -44.06 80.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.834 0.35 . . . . 0.0 111.428 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.41 95.96 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.995 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.602 ' HB2' HD11 ' A' ' 109' ' ' LEU . 34.2 tt0 -64.1 -37.98 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.605 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.8 mt-10 -62.51 -51.77 66.12 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.877 0.37 . . . . 0.0 110.956 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 63.9 m -60.84 -35.27 76.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.027 0.442 . . . . 0.0 110.886 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.526 ' HB1' ' HG3' ' A' ' 107' ' ' PRO . . . -67.85 -48.82 65.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.743 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.7 -14.82 55.68 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.073 0.463 . . . . 0.0 111.606 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -98.98 -63.05 1.16 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.412 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -84.9 -49.06 8.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.165 0.507 . . . . 0.0 112.136 -176.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -97.42 56.1 1.31 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.961 0.41 . . . . 0.0 111.469 -173.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.85 -33.95 38.52 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 170.77 44.99 0.03 OUTLIER Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.11 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.553 ' HB2' HD21 ' A' ' 56' ' ' LEU . 85.2 mt-30 -79.06 133.47 36.79 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.896 0.379 . . . . 0.0 111.713 -174.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.93 61.41 5.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.131 0.491 . . . . 0.0 112.154 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -171.79 29.9 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.439 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 53' ' ' GLN . 22.3 mt -106.56 141.77 37.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 88.1 t -125.88 117.55 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.548 174.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.542 HD11 ' HB3' ' A' ' 5' ' ' TYR . 66.0 tp -93.14 100.08 12.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.707 178.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.6 mt -75.81 109.35 9.35 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.719 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -99.57 112.04 24.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 175.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.1 t -120.72 138.33 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 121.008 0.433 . . . . 0.0 112.148 -175.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.491 ' HA ' HD22 ' A' ' 3' ' ' LEU . 9.0 pt-20 -69.23 108.4 3.63 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.722 0.772 . . . . 0.0 110.281 175.096 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.521 ' HB3' HG22 ' A' ' 2' ' ' THR . . . -85.69 1.56 48.9 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -169.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.55 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 39.8 mt-10 -80.76 -49.94 1.06 Allowed Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 76.0 Cg_exo -52.5 -48.63 20.9 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 122.336 2.024 . . . . 0.0 113.06 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 pp -92.79 10.79 29.4 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -57.78 -28.29 60.16 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 114.652 0.621 . . . . 0.0 114.652 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -66.31 -26.44 67.31 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.361 0.581 . . . . 0.0 111.533 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.37 11.84 30.48 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.259 177.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 82' ' ' PRO . 42.0 tp -113.69 102.97 10.76 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.36 107.32 19.07 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 59.9 m95 -69.39 84.57 0.4 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.793 0.806 . . . . 0.0 109.489 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -119.85 120.49 36.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.287 -167.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.12 89.26 1.14 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.02 0.438 . . . . 0.0 111.409 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.5 p -75.2 78.89 2.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.685 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 63.37 178.52 0.16 Allowed 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.498 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.65 -66.93 2.66 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.97 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.58 -19.84 2.03 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.794 -178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.503 ' HB1' ' NE2' ' A' ' 41' ' ' GLN . . . -83.84 129.18 34.94 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.209 0.528 . . . . 0.0 112.006 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.3 mtp85 -70.85 104.35 2.89 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.478 176.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -94.4 123.27 59.09 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 120.802 0.334 . . . . 0.0 111.419 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 70' ' ' LEU . 40.9 Cg_endo -67.42 109.15 1.74 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.531 2.154 . . . . 0.0 112.385 177.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -100.02 106.51 18.28 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.476 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.8 tp -93.5 138.67 31.56 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.97 0.414 . . . . 0.0 111.123 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.93 29.81 7.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.476 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 28.7 mmt180 -138.11 141.15 31.15 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 122.538 0.335 . . . . 0.0 111.711 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 23.2 Cg_exo -64.97 120.36 7.58 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.769 2.312 . . . . 0.0 112.298 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 62.7 tp -81.23 110.86 17.1 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.063 0.459 . . . . 0.0 111.527 -177.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.28 136.26 53.22 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.215 -0.303 . . . . 0.0 110.448 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 17' ' ' LYS . 91.4 t -58.37 -41.17 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.247 0.546 . . . . 0.0 110.935 178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.2 t -70.94 -10.08 59.03 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.828 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -95.73 -15.0 22.91 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.975 0.417 . . . . 0.0 111.333 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.25 145.0 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.968 0.413 . . . . 0.0 111.285 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 31.1 m -80.26 -50.77 9.76 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.909 0.385 . . . . 0.0 111.298 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.418 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 9.7 tpp180 -150.14 143.95 25.38 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.271 0.558 . . . . 0.0 111.788 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 9.1 pt-20 -116.41 98.76 6.75 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.081 173.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -89.09 87.36 7.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.165 0.507 . . . . 0.0 111.72 -176.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -67.95 103.93 1.6 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.333 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.3 tp 60.11 101.64 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.026 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 13.8 t70 -119.51 89.86 3.21 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.043 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.49 164.04 22.79 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 0.0 112.094 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.895 ' HB2' ' HB2' ' A' ' 108' ' ' GLN . 5.9 t70 -111.74 -169.41 1.46 Allowed 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.019 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.14 -25.75 61.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -89.41 0.93 56.49 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 75.96 5.56 80.36 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.69 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.4 t -89.45 135.8 30.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 122.32 0.248 . . . . 0.0 110.509 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.526 ' HG3' ' HB1' ' A' ' 46' ' ' ALA . 20.4 Cg_endo -59.44 95.95 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.289 1.993 . . . . 0.0 111.586 175.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.895 ' HB2' ' HB2' ' A' ' 102' ' ' ASP . 2.6 tp-100 -83.83 44.53 1.0 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.732 0.777 . . . . 0.0 110.699 -174.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.602 HD11 ' HB2' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.12 5.82 0.32 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.145 -0.934 . . . . 0.0 113.186 -176.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.95 -34.95 31.46 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.688 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -65.08 -27.63 68.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.034 0.445 . . . . 0.0 111.281 174.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -80.26 -24.2 40.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 120.973 0.416 . . . . 0.0 110.745 173.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.5 mt -105.59 -159.22 0.7 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.77 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -145.82 -28.71 0.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.54 142.85 38.81 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 176.291 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.805 0.336 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.0 m -74.54 -21.22 59.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -177.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.37 99.43 4.13 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.948 0.404 . . . . 0.0 111.714 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.588 HD12 HD13 ' A' ' 36' ' ' LEU . 15.4 pt -104.86 142.66 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 110.69 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -125.19 152.22 44.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.225 0.536 . . . . 0.0 112.098 -172.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HZ1' ' CG ' ' A' ' 28' ' ' ASP . 62.6 tttp -147.54 106.66 3.86 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.613 175.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -91.51 137.62 21.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.229 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.18 172.62 17.29 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.001 0.429 . . . . 0.0 111.268 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 94.4 p -76.24 146.4 39.05 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.054 0.454 . . . . 0.0 111.43 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -41.92 62.07 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.555 -179.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.46 -51.07 71.46 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.81 -29.48 69.96 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.028 0.442 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -70.23 -44.69 68.04 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.143 175.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -33.38 72.93 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.221 -0.3 . . . . 0.0 111.114 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.53 -40.96 88.9 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.853 175.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.58 79.52 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.379 174.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -58.6 -37.19 75.29 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.066 0.46 . . . . 0.0 111.211 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.73 -52.77 61.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.687 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 11.5 pt20 -77.24 -10.47 59.44 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 81.41 -45.14 3.18 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-O 121.354 0.419 . . . . 0.0 112.678 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.41 ' HG2' HD23 ' A' ' 89' ' ' LEU . 48.0 mtm180 -94.17 -173.93 3.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.451 0.643 . . . . 0.0 111.208 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -141.23 94.68 2.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.581 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -72.42 -20.91 61.34 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.91 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.85 152.89 6.67 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.043 -0.526 . . . . 0.0 113.073 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 86.2 p -91.12 -171.66 3.05 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.97 -53.57 15.63 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 64.0 t -59.88 -53.75 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.517 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 12.9 m-20 -57.96 -47.5 82.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.237 0.541 . . . . 0.0 111.713 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.89 -16.81 62.71 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.697 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -55.66 7.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -79.03 -51.59 9.38 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.44 -34.23 0.59 Allowed Glycine 0 CA--C 1.529 0.926 0 C-N-CA 120.298 -0.953 . . . . 0.0 114.561 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -131.1 157.08 44.07 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 117.455 0.627 . . . . 0.0 111.94 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.759 HD12 HD13 ' A' ' 88' ' ' LEU . 66.9 mt -70.58 114.83 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.577 0.703 . . . . 0.0 111.989 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -81.43 124.62 29.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.845 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 HD12 ' A' ' 4' ' ' ILE . 81.6 mt -109.82 111.31 22.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.702 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -77.85 105.85 9.31 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.288 0.566 . . . . 0.0 111.917 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.91 101.92 3.94 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.95 -95.99 0.01 OUTLIER Glycine 0 CA--C 1.532 1.098 0 N-CA-C 114.706 0.643 . . . . 0.0 114.706 173.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.39 -43.48 61.93 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.287 0.565 . . . . 0.0 111.366 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -63.13 -37.08 85.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.173 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -61.08 -44.66 97.03 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.628 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -67.0 -36.9 83.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.26 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.38 -56.7 17.4 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.912 0.386 . . . . 0.0 110.805 175.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.9 m -57.59 -38.56 75.07 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 111.377 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.87 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -68.34 -39.14 82.02 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.68 -19.25 60.34 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 111.712 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -93.2 -57.88 2.48 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.102 0.477 . . . . 0.0 111.565 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.71 -55.72 3.84 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -92.29 17.75 9.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -171.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -64.97 113.76 4.09 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.934 0.397 . . . . 0.0 111.428 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.77 25.96 73.96 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 114.237 0.455 . . . . 0.0 114.237 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -99.97 163.46 12.43 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 117.352 0.576 . . . . 0.0 111.451 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -109.21 174.18 5.98 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.862 -179.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 62.52 26.01 15.47 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.841 0.456 . . . . 0.0 112.029 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -88.47 111.48 21.86 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.75 135.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 121.006 0.431 . . . . 0.0 110.455 174.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.411 HD23 ' O ' ' A' ' 58' ' ' LEU . 7.4 tt -102.25 106.23 17.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.037 0.446 . . . . 0.0 110.465 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.496 HD22 HG21 ' A' ' 93' ' ' VAL . 61.3 mt -84.97 107.29 17.03 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.691 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.514 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -102.96 117.86 35.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.743 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 4' ' ' ILE . 53.4 t -117.57 116.24 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.518 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.62 95.77 0.89 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -42.53 -65.65 0.45 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -170.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 64.75 158.35 0.12 Allowed Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 120.789 0.328 . . . . 0.0 110.976 -173.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 57.36 3.4 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.234 1.956 . . . . 0.0 112.809 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.603 HD12 ' N ' ' A' ' 67' ' ' GLY . 1.6 pp -67.32 -28.88 68.35 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.603 ' N ' HD12 ' A' ' 66' ' ' LEU . . . 176.35 154.08 11.31 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.741 -179.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.51 -23.89 67.58 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.118 0.485 . . . . 0.0 111.438 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -65.71 -9.54 28.76 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.107 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.577 ' HB2' HD13 ' A' ' 84' ' ' LEU . 57.8 tp -98.54 100.89 12.17 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 168.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -116.36 133.47 55.99 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.094 0.473 . . . . 0.0 112.067 -176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -73.97 91.51 2.03 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.33 0.586 . . . . 0.0 110.259 172.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.31 143.08 35.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.173 -174.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -115.2 91.85 3.74 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 174.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.3 m -69.7 168.39 15.03 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.859 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.0 tpp85 -58.19 95.64 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.089 0.471 . . . . 0.0 111.354 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.87 -73.25 0.26 Allowed Glycine 0 CA--C 1.527 0.81 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.227 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 168.3 -158.26 30.89 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.364 -0.446 . . . . 0.0 113.015 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 62.29 -173.22 0.15 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -126.69 128.03 46.06 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.733 178.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -121.64 94.72 48.36 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.576 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.14 103.18 0.73 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.018 1.812 . . . . 0.0 112.226 178.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -101.41 115.52 30.7 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.336 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.577 HD13 ' HB2' ' A' ' 70' ' ' LEU . 30.2 tp -96.32 108.21 20.68 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.05 0.452 . . . . 0.0 109.938 175.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -81.0 55.32 2.44 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 120.891 0.377 . . . . 0.0 111.585 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -141.12 161.44 53.4 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.17 103.64 1.45 Allowed 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.532 2.155 . . . . 0.0 110.963 163.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.759 HD13 HD12 ' A' ' 34' ' ' ILE . 10.0 mp -75.71 122.86 24.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -169.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.41 HD23 ' HG2' ' A' ' 21' ' ' ARG . 33.1 mt -71.94 106.73 4.35 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.832 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 90' ' ' VAL . 42.3 t 54.14 39.1 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-O 122.2 1.0 . . . . 0.0 109.408 -171.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.753 ' HB2' HG23 ' A' ' 93' ' ' VAL . 70.9 m 56.5 19.85 4.44 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.36 -174.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 46.17 36.17 3.03 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.069 0.938 . . . . 0.0 110.813 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.753 HG23 ' HB2' ' A' ' 91' ' ' SER . 10.7 t -68.07 104.16 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.833 -176.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 70.0 m -74.73 -49.63 20.38 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.37 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 13.0 ttm180 -115.52 138.95 50.51 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.302 0.572 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -132.0 123.5 27.44 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.12 -176.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -147.31 146.75 29.82 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.47 131.81 39.25 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.213 174.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 107' ' ' PRO . 53.9 tp -63.97 128.2 34.77 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -173.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -91.96 112.39 24.3 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.679 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.8 mt -94.75 160.61 14.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.625 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -102.91 -171.44 1.95 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 111.605 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.01 15.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -111.55 -13.18 13.86 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.46 14.06 36.47 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.656 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.57 124.72 43.37 Favored Pre-proline 0 CA--C 1.541 0.625 0 O-C-N 122.647 -0.326 . . . . 0.0 111.279 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.87 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 53.0 Cg_exo -55.71 114.85 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.862 2.374 . . . . 0.0 113.177 177.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -75.61 84.9 2.65 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.347 0.594 . . . . 0.0 112.163 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 42' ' ' ALA . 4.3 mp -81.7 -11.55 59.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.52 174.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -54.79 -33.15 55.58 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.822 176.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.93 -27.73 63.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.15 0.5 . . . . 0.0 110.935 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -79.16 -44.86 21.09 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.235 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.6 mt -78.01 162.29 26.85 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.595 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.5 100.53 2.75 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.14 127.92 34.19 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.876 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.887 0.375 . . . . 0.0 111.427 -179.656 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.9 mtt . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.8 p -88.2 177.52 6.87 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.894 0.378 . . . . 0.0 111.53 178.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.07 134.58 38.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.85 0.357 . . . . 0.0 111.675 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.482 HG23 ' HB2' ' A' ' 63' ' ' ALA . 22.5 pt -116.39 143.65 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.811 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 58.1 m-85 -126.24 135.63 51.82 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.965 0.412 . . . . 0.0 112.061 -175.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -134.44 115.01 13.49 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.373 173.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.8 mt -90.56 131.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.735 0.302 . . . . 0.0 110.778 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.437 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.9 pt? -147.61 161.2 41.63 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.034 0.445 . . . . 0.0 111.465 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.7 p -69.92 155.66 40.24 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.17 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HB2' ' HB3' ' A' ' 55' ' ' ASN . 38.9 tpt85 -55.61 -33.3 63.85 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.93 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.81 -56.24 21.51 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.904 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -52.88 -47.58 67.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.244 0.545 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -70.43 -41.35 73.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.313 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.99 -52.67 58.51 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 110.735 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.62 -50.76 64.97 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.007 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 22' ' ' PHE . . . -58.46 -43.24 88.79 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.527 177.059 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -61.56 -39.66 91.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.936 0.398 . . . . 0.0 111.257 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.96 -33.59 65.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 176.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -74.97 -24.23 58.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.514 176.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.56 -10.43 61.91 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.523 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -159.08 141.51 13.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.519 . . . . 0.0 112.403 -178.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.564 ' CZ ' HD22 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -120.32 116.09 24.85 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.402 0.62 . . . . 0.0 111.573 173.411 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 87' ' ' PRO . 10.1 pt-20 -76.64 2.47 14.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.891 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 129.32 166.39 11.9 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.881 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 51.3 m -75.97 176.5 7.84 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.732 -0.275 . . . . 0.0 110.744 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.6 -52.66 63.03 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.035 0.445 . . . . 0.0 111.223 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.52 -50.21 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.286 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 2.4 m-20 -52.46 -60.53 3.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.95 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.49 -28.15 66.78 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.218 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.45 -46.25 70.32 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -88.45 -32.21 18.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.92 -66.25 0.31 Allowed Glycine 0 CA--C 1.526 0.773 0 C-N-CA 120.17 -1.014 . . . . 0.0 114.513 174.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -111.66 162.44 15.19 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.383 0.611 . . . . 0.0 112.256 -172.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.579 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 61.3 mt -66.78 136.27 27.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.606 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -92.14 120.17 32.48 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.012 0.435 . . . . 0.0 111.794 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.71 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 67.1 mt -116.83 169.16 9.6 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.183 175.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.0 m -139.56 154.96 47.75 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.081 0.467 . . . . 0.0 111.712 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.23 113.61 25.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.483 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.3 -107.09 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 114.343 0.497 . . . . 0.0 114.343 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -50.02 -47.08 53.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.043 0.537 . . . . 0.0 112.439 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -57.25 -25.63 59.47 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.34 -49.07 46.12 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 111.002 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.589 ' HB2' HD11 ' A' ' 109' ' ' LEU . 55.8 tt0 -65.85 -36.76 84.35 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.021 0.439 . . . . 0.0 110.856 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.98 -52.61 64.27 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.064 174.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.5 m -57.84 -33.33 68.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.807 0.336 . . . . 0.0 111.128 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.03 -54.48 45.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.902 0.382 . . . . 0.0 110.87 174.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.17 -30.32 69.26 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.024 0.44 . . . . 0.0 111.978 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -76.81 -46.79 23.61 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -110.36 -57.56 2.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.406 0.622 . . . . 0.0 112.385 -174.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.57 ' HB3' HD13 ' A' ' 56' ' ' LEU . 74.6 m-85 -95.2 60.65 2.34 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.423 0.63 . . . . 0.0 111.275 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -73.05 -34.54 66.35 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -174.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 176.91 65.88 0.06 OUTLIER Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.528 -0.844 . . . . 0.0 113.815 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.57 24.63 10.82 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.54 -0.388 . . . . 0.0 111.815 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 55.48 120.85 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 10' ' ' ARG . 88.0 m-20 64.74 89.44 0.09 Allowed 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.678 0.752 . . . . 0.0 111.809 -176.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 50' ' ' PHE . 58.5 mt -121.24 111.35 17.27 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.779 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.407 ' O ' HD23 ' A' ' 8' ' ' LEU . 55.4 t -84.99 128.88 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.329 0.585 . . . . 0.0 112.475 -171.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.519 ' HB2' HD11 ' A' ' 99' ' ' LEU . 66.5 tp -97.06 115.1 26.88 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.239 172.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 83.8 mt -88.89 107.74 19.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 0.0 110.971 176.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.14 100.67 10.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.596 178.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.494 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 48.3 t -114.69 132.35 64.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.722 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.9 92.43 1.26 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 171.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.482 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -45.06 -66.78 0.35 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -163.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.8 mm-40 68.69 157.43 0.15 Allowed Pre-proline 0 N--CA 1.473 0.682 0 CA-C-O 121.094 0.473 . . . . 0.0 111.129 -168.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -59.06 -41.34 62.03 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.929 1.752 . . . . 0.0 112.194 171.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.3 mt 70.81 -53.12 0.67 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.946 0.898 . . . . 0.0 111.002 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.17 -77.61 0.05 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.83 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -141.93 7.19 1.83 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 123.16 0.584 . . . . 0.0 110.695 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.546 ' OD2' ' HG3' ' A' ' 86' ' ' ARG . 4.7 m-20 -67.95 -52.1 39.91 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -164.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.8 tp -69.27 97.92 0.99 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.712 0.768 . . . . 0.0 111.419 -170.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -99.23 105.15 17.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.222 -177.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -75.06 101.67 4.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.201 0.524 . . . . 0.0 110.639 176.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.97 102.44 2.41 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.608 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -108.24 86.09 2.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.063 0.459 . . . . 0.0 110.808 175.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -110.54 -150.96 0.47 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.058 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.4 mtm180 -67.54 79.34 0.17 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.308 0.575 . . . . 0.0 110.854 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.47 160.23 22.23 Favored Glycine 0 CA--C 1.525 0.694 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.711 -178.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.87 -34.33 21.92 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.699 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -83.37 132.5 34.99 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 122.433 -0.451 . . . . 0.0 112.055 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -89.42 116.59 27.72 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.828 0.347 . . . . 0.0 110.773 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -98.99 112.33 62.72 Favored Pre-proline 0 N--CA 1.472 0.666 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.71 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 17.6 Cg_exo -66.41 135.5 39.77 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.528 2.152 . . . . 0.0 113.404 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -121.44 154.45 36.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.475 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.579 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 23.8 tp -123.09 140.81 52.64 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.568 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -82.17 -62.46 1.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.546 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 13.0 mtm-85 -71.87 155.76 91.73 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -174.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HA ' ' HA ' ' A' ' 23' ' ' GLU . 51.9 Cg_exo -56.76 115.8 2.74 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.313 2.009 . . . . 0.0 111.516 168.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' A' ' 22' ' ' PHE . 2.5 tt -64.83 116.6 6.49 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 111.715 -171.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.1 mt -78.64 128.96 34.19 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.049 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.52 -33.76 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-O 120.764 0.316 . . . . 0.0 111.483 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 63.7 p -65.46 -28.09 68.97 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.847 0.356 . . . . 0.0 111.603 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.57 -20.11 58.84 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.03 119.42 17.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.949 175.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.494 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 57.0 p -74.93 -63.7 1.2 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -120.45 142.86 48.86 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.613 0.72 . . . . 0.0 112.914 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -132.55 148.59 52.38 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.32 176.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.53 138.79 15.68 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -84.14 127.57 34.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.89 0.376 . . . . 0.0 110.389 177.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 58' ' ' LEU . 94.6 mt -91.62 119.26 31.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.122 0.487 . . . . 0.0 112.223 -176.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.58 154.5 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.02 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -150.07 149.81 30.84 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.201 0.525 . . . . 0.0 112.183 -176.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -100.48 -172.53 2.22 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.631 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.4 7.84 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.04 -10.74 52.3 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.242 0.544 . . . . 0.0 110.204 177.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.5 36.6 58.88 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.79 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 72.5 t -139.44 116.96 8.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.439 ' HA ' ' HB3' ' A' ' 101' ' ' LEU . 36.5 Cg_endo -66.52 98.85 0.41 Allowed 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 121.951 1.767 . . . . 0.0 110.681 167.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -74.84 84.35 2.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.6 0.714 . . . . 0.0 112.44 -169.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.589 HD11 ' HB2' ' A' ' 43' ' ' GLN . 2.2 pp -96.08 5.68 50.57 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.821 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.55 -24.44 56.53 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.436 -0.412 . . . . 0.0 113.639 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -77.56 -11.39 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.147 0.499 . . . . 0.0 111.353 174.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -98.98 -47.64 5.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.179 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.72 166.66 11.38 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -176.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 57.59 93.52 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.335 0.588 . . . . 0.0 111.5 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.5 tp -90.58 137.07 32.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.11 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 121.029 0.442 . . . . 0.0 110.872 174.025 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.0 p -79.17 154.6 29.16 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.894 0.378 . . . . 0.0 111.025 175.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.1 mt -112.96 130.95 55.94 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.962 0.41 . . . . 0.0 111.66 -177.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 70' ' ' LEU . 24.0 pt -105.01 146.17 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.723 174.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.453 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 44.1 m-85 -129.85 164.23 24.58 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.247 0.546 . . . . 0.0 112.148 -172.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE2' ' HG ' ' A' ' 36' ' ' LEU . 24.5 ttmm -156.52 106.76 2.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.809 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.1 mt -88.89 135.9 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.945 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.448 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.0 pt? -152.24 166.93 30.23 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.952 0.406 . . . . 0.0 111.305 -177.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 t -75.68 150.48 37.9 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.858 0.361 . . . . 0.0 111.096 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.545 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . 8.7 tpt180 -56.82 -35.67 69.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.043 0.449 . . . . 0.0 110.839 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.71 -37.47 73.57 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.373 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -75.88 -38.84 57.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.122 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -69.15 -48.43 62.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.33 -37.67 84.13 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.207 -0.308 . . . . 0.0 111.587 175.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.47 -45.29 92.05 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.064 0.459 . . . . 0.0 110.648 174.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.7 -53.02 62.94 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.563 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -61.84 -27.57 68.87 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.887 0.375 . . . . 0.0 111.66 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.63 -51.36 51.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.957 0.408 . . . . 0.0 111.403 176.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 12.6 pt20 -87.88 3.27 49.08 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.85 -1.01 48.79 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.502 -0.38 . . . . 0.0 114.034 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -149.14 149.21 30.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 122.406 -0.467 . . . . 0.0 111.513 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -110.42 132.87 53.8 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.46 0.648 . . . . 0.0 111.872 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -106.61 130.57 54.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.087 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -47.75 -71.28 0.58 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.52 0.568 . . . . 0.0 114.52 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 44.3 t 179.4 159.34 0.68 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.713 0.405 . . . . 0.0 110.143 -178.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -55.19 35.45 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.3 p -63.15 -33.32 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 111.813 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.576 ' HB2' ' HB3' ' A' ' 25' ' ' SER . 22.1 t0 -62.1 -58.44 7.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.251 0.548 . . . . 0.0 110.481 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.97 -33.83 76.61 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.04 -37.95 89.31 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -75.99 -34.57 59.75 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.755 0.312 . . . . 0.0 110.771 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 165.12 -68.86 0.2 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 120.151 -1.023 . . . . 0.0 114.566 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.576 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 52.9 m-85 -145.45 141.84 28.73 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 122.42 -0.459 . . . . 0.0 111.738 -167.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 62.1 mt -50.96 107.09 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -174.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -80.53 127.93 33.01 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.281 0.562 . . . . 0.0 111.474 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HG ' ' HE2' ' A' ' 6' ' ' LYS . 7.3 mp -91.32 -46.33 8.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.5 m 66.5 97.06 0.05 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.158 0.504 . . . . 0.0 110.973 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.52 155.92 19.1 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.74 -119.92 18.92 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.721 -0.672 . . . . 0.0 113.939 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.404 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.7 mp0 -59.74 -40.0 86.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.118 0.485 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -67.39 -29.13 68.56 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.141 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.19 -50.87 59.39 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.138 0.494 . . . . 0.0 110.895 176.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.8 tp60 -57.41 -47.52 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.251 175.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.539 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 33.1 tt0 -61.35 -48.36 81.64 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.302 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -60.82 -37.86 83.43 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 120.952 0.405 . . . . 0.0 111.162 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.413 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.43 -40.84 83.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.74 175.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.12 -25.62 61.8 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.024 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.539 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 65.1 mttm -74.78 -69.43 0.46 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.39 0.614 . . . . 0.0 111.669 177.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.3 m0 -75.0 -60.68 2.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.503 -0.771 . . . . 0.0 112.4 -170.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -82.92 -66.33 0.9 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.575 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 70.81 -65.54 0.33 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -151.48 56.19 0.45 Allowed Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.57 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.627 ' HB2' HD21 ' A' ' 56' ' ' LEU . 26.0 mt-30 -99.81 -164.66 1.14 Allowed 'General case' 0 CA--C 1.539 0.544 0 O-C-N 122.774 -0.251 . . . . 0.0 110.834 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.67 -67.19 0.89 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.545 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 15.4 p-10 -97.33 67.7 2.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.857 0.837 . . . . 0.0 111.728 -168.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.627 HD21 ' HB2' ' A' ' 53' ' ' GLN . 37.7 mt -94.71 124.78 38.95 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.542 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 t -110.65 148.64 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.26 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.0 tt -122.27 118.77 29.33 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.824 0.345 . . . . 0.0 110.799 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.6 mt -90.85 131.56 36.41 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.56 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -128.53 125.08 37.59 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.904 0.383 . . . . 0.0 111.519 -178.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.99 134.5 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 120.869 0.366 . . . . 0.0 111.128 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -74.53 138.4 43.09 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 175.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.416 ' O ' ' HG ' ' A' ' 66' ' ' LEU . . . -48.39 -70.51 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.496 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 28.2 mt-10 61.24 167.98 0.09 OUTLIER Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.496 ' HD2' ' HB3' ' A' ' 64' ' ' GLU . 82.8 Cg_exo -52.24 5.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.503 0 C-N-CA 123.711 2.941 . . . . 0.0 116.356 176.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 63' ' ' ALA . 4.3 pp -88.35 10.34 20.23 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.315 -0.865 . . . . 0.0 111.656 178.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -71.83 27.13 0.63 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.504 0.562 . . . . 0.0 114.504 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.17 -35.4 9.67 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.23 -0.571 . . . . 0.0 110.247 173.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -78.76 -12.69 60.03 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.13 175.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 4' ' ' ILE . 51.5 tp -114.0 134.19 55.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.814 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -137.25 134.57 36.33 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.966 0.413 . . . . 0.0 111.416 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.515 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 73.0 m95 -83.66 89.41 7.12 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.97 0.414 . . . . 0.0 110.721 177.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.39 117.6 31.2 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.097 0.475 . . . . 0.0 112.131 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.436 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -89.49 114.12 25.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.037 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.3 m -117.78 36.24 4.38 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -164.26 -36.38 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 0.0 111.657 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 141.17 100.58 0.42 Allowed Glycine 0 CA--C 1.526 0.723 0 C-N-CA 121.182 -0.533 . . . . 0.0 113.038 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.8 -47.05 3.72 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.18 104.45 1.82 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 122.414 -0.463 . . . . 0.0 111.484 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.515 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 50.4 mtm180 -92.9 107.82 19.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.962 0.411 . . . . 0.0 111.365 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -84.31 114.68 56.25 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.408 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.51 111.45 1.66 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.406 2.071 . . . . 0.0 112.245 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.576 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 57.8 m170 -106.6 133.93 50.52 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.589 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.8 tp -100.22 120.42 39.87 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.924 0.392 . . . . 0.0 110.293 177.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -79.52 7.09 8.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -174.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -145.43 155.43 53.64 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 122.357 -0.214 . . . . 0.0 111.116 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.31 135.75 61.06 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.683 2.256 . . . . 0.0 113.072 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 61.5 tp -80.49 88.72 5.62 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.053 0.454 . . . . 0.0 111.232 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.2 mt -61.36 141.84 57.33 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.282 -0.261 . . . . 0.0 110.532 176.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 87.9 t -58.17 -27.45 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.05 0.453 . . . . 0.0 111.138 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.2 t -65.69 -23.7 66.83 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.36 -21.12 53.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.782 0.325 . . . . 0.0 111.536 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.8 t -76.73 87.86 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.05 0.453 . . . . 0.0 110.929 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.529 HG22 ' HG3' ' A' ' 95' ' ' ARG . 97.8 m -59.87 -48.55 81.23 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.115 -178.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.529 ' HG3' HG22 ' A' ' 94' ' ' THR . 69.2 mtm180 -134.12 148.13 50.94 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.633 0.254 . . . . 0.0 111.345 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -157.74 153.33 26.4 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.749 0.309 . . . . 0.0 111.609 177.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -169.18 151.26 4.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -73.14 126.31 29.73 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.74 174.83 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -170.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 23.4 t70 -107.91 129.16 55.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.616 -177.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.581 HD21 HD12 ' A' ' 56' ' ' LEU . 80.9 mt -96.56 152.06 18.99 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.993 0.425 . . . . 0.0 111.91 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.658 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 28.1 t70 -86.3 174.71 8.88 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.92 177.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.33 65.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -96.27 9.42 41.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.139 0.495 . . . . 0.0 111.052 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.503 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 93.52 -33.98 4.86 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 121.243 -0.503 . . . . 0.0 113.658 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.8 t -54.41 122.82 40.13 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.436 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 31.2 Cg_exo -59.84 103.97 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 112.264 176.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.658 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 83.6 mm-40 -76.55 68.36 2.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.444 0.64 . . . . 0.0 111.77 -177.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 112' ' ' HIS . 2.3 pp -100.32 5.39 44.47 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.538 176.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.93 -49.3 72.26 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.482 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.16 -19.62 62.4 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.215 0.531 . . . . 0.0 111.079 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' HIS . . . . . 0.455 ' HB3' ' O ' ' A' ' 109' ' ' LEU . 73.3 t60 -76.73 -30.1 56.48 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.349 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.443 HD22 ' CZ ' ' A' ' 5' ' ' TYR . 30.5 mt -104.03 -149.38 0.41 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.131 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.02 118.36 6.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.931 0.396 . . . . 0.0 111.997 -178.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.544 HD23 ' O ' ' A' ' 115' ' ' LEU . 9.8 tt -85.04 -7.71 59.01 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.19 0.519 . . . . 0.0 110.696 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.109 -179.313 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.541 ' O ' HG23 ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.624 0.249 . . . . 0.0 110.622 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.541 HG23 ' O ' ' A' ' 1' ' ' MET . 0.8 OUTLIER -171.05 80.04 0.08 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.435 0.694 . . . . 0.0 110.752 -178.57 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.8 mt -87.8 113.77 23.78 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -174.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.566 HD12 HD22 ' A' ' 36' ' ' LEU . 25.7 pt -98.51 141.79 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 170.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.511 ' HB3' HD11 ' A' ' 58' ' ' LEU . 92.2 m-85 -117.38 147.4 42.68 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.657 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 77.7 tttt -151.93 118.1 5.56 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -93.19 149.57 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-O 120.96 0.41 . . . . 0.0 111.678 -176.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -160.27 171.44 19.16 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.99 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -79.89 145.65 32.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.86 0.362 . . . . 0.0 111.148 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.43 -29.99 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.524 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.03 -59.48 5.29 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.381 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.86 -34.31 74.4 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.823 0.344 . . . . 0.0 111.639 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -64.32 -47.73 78.3 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.912 0.387 . . . . 0.0 111.869 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.23 -40.12 86.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.464 0.65 . . . . 0.0 110.125 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.68 72.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.027 174.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.91 97.94 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 174.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.54 -35.83 78.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.294 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.17 -27.43 63.82 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.925 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -109.28 -0.78 18.98 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.011 0.434 . . . . 0.0 111.61 176.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.13 -0.53 46.46 Favored Glycine 0 CA--C 1.53 1.013 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 176.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -136.16 155.27 50.39 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.948 -0.737 . . . . 0.0 111.582 -175.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.657 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 44.1 t80 -128.95 160.8 31.54 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.072 172.105 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.557 ' HB3' HD13 ' A' ' 34' ' ' ILE . 67.1 mt-10 73.96 -168.39 0.11 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.599 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.21 22.44 70.88 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.304 -173.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.3 t -88.39 -177.23 5.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.896 0.478 . . . . 0.0 111.573 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.43 -42.49 32.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.1 t -56.79 -39.61 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 120.903 0.382 . . . . 0.0 111.717 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.34 -50.83 58.34 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.088 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.88 -27.26 68.08 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.79 0.329 . . . . 0.0 111.688 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.44 -56.03 4.89 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.069 0.461 . . . . 0.0 112.039 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -80.49 -29.71 37.35 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 118.25 -27.42 7.35 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.975 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -152.08 166.5 31.42 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.212 0.529 . . . . 0.0 111.597 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.557 HD13 ' HB3' ' A' ' 23' ' ' GLU . 50.4 mt -80.18 149.44 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.798 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -111.86 121.19 44.36 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.007 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.622 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 6.2 mp -119.28 -175.42 2.93 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 171.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.9 m -146.71 153.4 40.21 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.05 -166.83 1.7 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.824 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.8 -69.99 1.11 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 114.138 0.415 . . . . 0.0 114.138 -175.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.18 88.25 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.922 0.392 . . . . 0.0 111.59 -177.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -61.34 -46.24 91.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.489 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -62.07 -42.59 99.36 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.742 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -59.9 -48.72 80.55 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 120.989 0.424 . . . . 0.0 111.555 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -73.12 -41.29 64.16 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.4 m -59.5 -42.0 91.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.973 0.416 . . . . 0.0 111.104 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.444 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.87 -42.49 89.55 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.063 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.21 68.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -82.44 -63.22 1.42 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.07 0.462 . . . . 0.0 112.058 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -74.31 -40.13 62.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -172.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -117.02 34.45 5.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.128 0.489 . . . . 0.0 110.907 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 51' ' ' ARG . 2.9 ptm180 -36.06 -52.7 0.77 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -176.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.633 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -156.29 47.25 0.49 Allowed Glycine 0 CA--C 1.522 0.524 0 C-N-CA 120.858 -0.687 . . . . 0.0 113.495 -176.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.581 ' HB2' HD21 ' A' ' 56' ' ' LEU . 64.2 mt-30 -87.5 158.5 18.92 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.722 0.296 . . . . 0.0 110.893 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.38 128.89 34.99 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 67.56 84.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.828 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.581 HD21 ' HB2' ' A' ' 53' ' ' GLN . 96.1 mt -112.69 129.83 56.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.531 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.419 ' O ' HD23 ' A' ' 8' ' ' LEU . 60.3 t -102.64 130.79 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.057 0.456 . . . . 0.0 111.439 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.6 tp -99.44 104.03 15.85 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 175.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.427 HD22 HG11 ' A' ' 93' ' ' VAL . 82.7 mt -76.29 109.81 10.29 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.075 0.464 . . . . 0.0 111.376 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.474 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -101.12 115.84 31.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.41 175.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 4' ' ' ILE . 51.8 t -126.24 131.86 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.636 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 18.6 tt0 -92.22 105.28 17.53 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.17 0.509 . . . . 0.0 111.985 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.58 84.85 7.06 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.425 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.595 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 41.2 mt-10 -80.58 -44.8 1.32 Allowed Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 178.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 10.9 Cg_endo -53.9 -62.27 0.33 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.828 1.685 . . . . 0.0 112.294 177.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 70' ' ' LEU . 18.6 tp 57.13 22.92 7.97 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.23 0.538 . . . . 0.0 111.985 172.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -93.77 -83.31 1.57 Allowed Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.501 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -102.34 5.56 39.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.029 0.442 . . . . 0.0 111.167 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.516 ' O ' HD12 ' A' ' 84' ' ' LEU . 4.0 p-10 -92.79 -64.17 1.13 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.182 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.58 ' HB3' HD12 ' A' ' 66' ' ' LEU . 42.0 tp -107.89 147.7 30.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.916 0.388 . . . . 0.0 111.09 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -136.63 101.04 4.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.006 0.432 . . . . 0.0 111.94 -174.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -70.28 119.82 15.03 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -158.32 144.63 17.27 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.602 -172.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.46 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -149.51 158.1 43.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.251 0.548 . . . . 0.0 112.407 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.6 m -154.78 126.74 7.64 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.176 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 76' ' ' ARG . 3.8 mpt_? 69.83 -59.99 0.49 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 176.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.2 -15.38 44.16 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.352 0.501 . . . . 0.0 114.352 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 79.2 -45.07 2.74 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.608 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.81 134.86 57.51 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.931 0.396 . . . . 0.0 112.047 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.46 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 83.6 mtt180 -79.1 110.89 14.77 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.153 -177.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 80.2 m-85 -95.17 117.64 66.69 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-O 120.756 0.313 . . . . 0.0 111.712 -177.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 81' ' ' PHE . 18.5 Cg_exo -66.82 102.19 0.61 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.661 2.24 . . . . 0.0 112.374 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -90.94 115.4 27.94 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.133 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.516 HD12 ' O ' ' A' ' 69' ' ' ASP . 55.2 tp -105.24 130.57 53.36 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.707 0.289 . . . . 0.0 110.543 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -110.32 37.11 2.82 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 20.5 ptp180 -167.55 138.42 2.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 O-C-N 122.452 -0.155 . . . . 0.0 110.986 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 26.8 Cg_exo -62.48 149.33 91.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 122.721 2.281 . . . . 0.0 113.046 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -108.99 118.56 37.11 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.33 0.586 . . . . 0.0 111.282 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -71.04 135.56 47.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.058 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 30.0 m -57.88 -35.24 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -172.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -72.54 -3.77 26.56 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.729 0.3 . . . . 0.0 111.722 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -98.01 -11.86 22.55 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.808 0.337 . . . . 0.0 111.77 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.427 HG11 HD22 ' A' ' 59' ' ' LEU . 57.6 t -66.61 124.81 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 O-C-N 122.319 -0.238 . . . . 0.0 111.407 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 40.8 m -59.72 -38.83 82.74 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.768 0.318 . . . . 0.0 111.645 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -160.85 143.13 12.55 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.301 0.572 . . . . 0.0 112.231 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.3 pt-20 -106.7 84.07 1.95 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.489 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.52 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -74.6 84.31 2.06 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.216 0.532 . . . . 0.0 112.209 -175.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 102.22 1.59 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.573 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 pp -116.15 168.37 10.17 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -122.87 176.12 6.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.521 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.633 HD11 ' HA2' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -158.74 179.07 9.44 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.816 -179.221 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -113.87 170.28 8.38 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.478 0.656 . . . . 0.0 112.127 170.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.75 94.02 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.366 -178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 91.25 -6.58 0.26 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.791 0.836 . . . . 0.0 109.678 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -60.19 -39.89 96.54 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.501 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 t 67.13 141.14 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 123.951 0.442 . . . . 0.0 112.153 169.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.558 ' HD3' HD13 ' A' ' 101' ' ' LEU . 53.2 Cg_exo -35.01 101.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 123.138 2.559 . . . . 0.0 113.888 -173.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -70.4 80.22 0.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.567 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.4 mp -79.39 -23.56 43.2 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.307 -0.406 . . . . 0.0 112.072 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.59 -41.5 26.17 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.635 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -78.05 -13.67 59.79 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 26.1 m170 -95.58 -13.12 24.67 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.615 0.245 . . . . 0.0 111.173 179.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 42.7 mt -110.33 162.66 14.42 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 65.94 -72.05 0.08 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 170.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 52.2 tp -87.88 152.3 22.19 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.4 0.619 . . . . 0.0 112.519 -171.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 . . . . . 0 CA--C 1.538 0.494 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.864 175.795 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.9 mmt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.219 0.533 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 53.3 p -79.14 29.38 0.22 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -177.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.7 mt -81.98 105.96 13.51 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.987 -0.446 . . . . 0.0 111.406 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.44 ' CG2' ' HB3' ' A' ' 36' ' ' LEU . 13.6 mt -92.35 142.92 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.19 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -130.72 119.42 22.33 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.664 0.269 . . . . 0.0 111.609 -177.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 35' ' ' HIS . 33.8 ttpt -127.24 123.06 35.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.651 0.262 . . . . 0.0 111.673 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.479 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.1 mp -91.69 138.14 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -178.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.42 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.8 pt? -149.69 174.54 12.46 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.189 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.413 ' OG ' ' HG2' ' A' ' 12' ' ' GLU . 83.9 p -82.48 151.97 26.28 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.943 -0.473 . . . . 0.0 111.063 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -30.06 64.37 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.832 0.348 . . . . 0.0 110.497 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.37 39.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.26 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HG2' ' OG ' ' A' ' 9' ' ' SER . 12.3 mm-40 -58.29 -43.55 88.11 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 111.144 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.52 ' CH2' HG13 ' A' ' 90' ' ' VAL . 28.4 t-105 -62.74 -51.74 65.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.678 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.56 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 12.4 t70 -59.44 -47.42 85.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.327 0.584 . . . . 0.0 110.784 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.41 -46.71 76.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.467 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.72 74.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.56 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 10.4 mtmp? -65.71 -27.92 68.68 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.683 0.278 . . . . 0.0 110.958 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.27 83.68 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.135 0.493 . . . . 0.0 111.091 173.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -80.23 -26.53 39.04 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.235 0.541 . . . . 0.0 110.856 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.06 -10.77 51.87 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.447 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HG2' HD13 ' A' ' 89' ' ' LEU . 24.8 mtt-85 -135.73 121.68 19.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.59 -0.359 . . . . 0.0 110.821 -178.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -78.6 86.67 4.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 172.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.11 80.27 9.24 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.194 0.521 . . . . 0.0 112.089 -174.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.67 -135.35 48.68 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.58 -0.737 . . . . 0.0 114.565 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.494 ' O ' ' HB3' ' A' ' 28' ' ' ASP . 46.5 t 170.42 177.48 0.05 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.627 0.771 . . . . 0.0 110.25 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.41 -49.12 77.24 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 122.003 -0.436 . . . . 0.0 111.865 -179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.493 HG22 ' NE2' ' A' ' 35' ' ' HIS . 10.7 p -65.33 -24.52 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 111.597 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.494 ' HB3' ' O ' ' A' ' 25' ' ' SER . 0.3 OUTLIER -64.12 -53.66 46.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.758 175.094 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.27 -30.61 68.42 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 120.621 0.248 . . . . 0.0 111.082 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.17 77.92 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.868 0.366 . . . . 0.0 111.709 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.51 ' HB3' ' CD1' ' A' ' 33' ' ' PHE . 3.5 m-20 -87.91 -29.67 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.103 0.477 . . . . 0.0 111.566 173.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.18 -6.67 81.28 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.902 -170.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.608 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -151.45 143.81 24.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.225 0.61 . . . . 0.0 111.092 -177.903 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mt -60.53 130.42 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -168.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.493 ' NE2' HG22 ' A' ' 27' ' ' VAL . 33.7 m-70 -72.45 140.12 48.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.736 170.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB3' ' CG2' ' A' ' 4' ' ' ILE . 3.4 mp -145.61 -64.51 0.32 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.68 0.276 . . . . 0.0 110.714 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 56.2 m 78.71 160.29 0.19 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.81 177.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -97.72 177.58 5.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.864 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -41.86 -47.97 5.13 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 114.677 0.631 . . . . 0.0 114.677 -175.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -54.61 -69.02 0.14 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.426 0.631 . . . . 0.0 111.781 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 22.2 mp0 -68.91 -20.09 64.22 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.888 -175.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.96 -56.52 8.71 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.698 0.285 . . . . 0.0 111.358 178.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -61.74 -39.82 92.92 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 111.728 0.269 . . . . 0.0 111.728 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -58.97 -56.4 22.75 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.979 0.419 . . . . 0.0 110.935 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -56.02 -34.02 65.44 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.122 176.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.54 -49.42 73.55 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.624 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.24 -33.07 74.69 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.054 0.454 . . . . 0.0 111.911 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -77.05 -53.03 8.31 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.36 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -88.79 -42.26 12.02 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -174.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -112.74 57.12 0.66 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.169 0.509 . . . . 0.0 110.713 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -4.54 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -172.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.88 73.63 0.02 OUTLIER Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.372 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.573 ' HB2' HD21 ' A' ' 56' ' ' LEU . 88.0 mt-30 -107.3 26.0 10.73 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 121.452 0.644 . . . . 0.0 110.996 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 64.46 -78.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.49 63.22 7.22 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.576 0.703 . . . . 0.0 111.367 -172.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.693 HD12 HD21 ' A' ' 101' ' ' LEU . 52.2 mt -88.5 138.92 31.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.606 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' HD23 ' A' ' 8' ' ' LEU . 59.7 t -123.51 141.92 42.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.648 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 8.8 tt -109.38 115.4 29.88 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.899 0.38 . . . . 0.0 110.615 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.1 108.59 13.82 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.87 0.366 . . . . 0.0 111.317 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.04 110.38 22.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.5 t -120.01 116.68 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.45 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.445 ' HG2' ' OG1' ' A' ' 94' ' ' THR . 11.8 pt-20 -79.41 103.38 9.29 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.594 0.711 . . . . 0.0 110.902 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.16 40.62 0.27 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.142 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -75.85 -45.89 3.98 Favored Pre-proline 0 CA--C 1.548 0.888 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -83.75 -157.23 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 122.216 1.944 . . . . 0.0 112.374 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 69' ' ' ASP . 90.5 mt 67.83 -55.38 0.49 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.366 1.066 . . . . 0.0 112.072 -177.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.08 -102.94 1.3 Allowed Glycine 0 CA--C 1.528 0.906 0 CA-C-N 116.213 -0.449 . . . . 0.0 113.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -69.82 -13.92 62.5 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 66' ' ' LEU . 58.1 m-20 -67.27 -17.62 64.87 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.5 tp -123.33 149.88 44.32 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.456 ' NZ ' ' OH ' ' A' ' 85' ' ' TYR . 8.1 ttpm? -149.25 128.36 12.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.925 0.393 . . . . 0.0 111.308 171.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.416 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 53.4 m95 -72.55 86.79 1.19 Allowed 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -86.17 128.89 34.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.961 -169.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.586 ' HB2' HH11 ' A' ' 80' ' ' ARG . . . -76.58 152.01 36.09 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.482 0.658 . . . . 0.0 112.729 -176.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.0 t -130.93 -178.64 4.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.0 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -55.44 103.45 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.913 0.485 . . . . 0.0 111.682 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.25 -16.62 5.7 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.473 -0.394 . . . . 0.0 112.916 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.45 -2.64 59.18 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.324 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.51 140.35 57.99 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.704 -0.292 . . . . 0.0 111.757 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.586 HH11 ' HB2' ' A' ' 74' ' ' ALA . 24.9 mmm180 -102.66 111.91 24.44 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.734 0.302 . . . . 0.0 111.262 -177.278 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -107.45 114.15 61.06 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-O 120.637 0.256 . . . . 0.0 111.364 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 37' ' ' SER . 43.6 Cg_endo -67.37 103.09 0.75 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.35 2.034 . . . . 0.0 112.819 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 31.3 m80 -98.91 129.82 45.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.928 176.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.43 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 36.3 tp -95.07 137.26 34.37 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.456 ' OH ' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 m-85 -105.61 12.91 30.65 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -173.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.43 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 44.4 mtm180 -141.67 154.44 66.14 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 122.664 0.386 . . . . 0.0 110.695 173.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.6 132.63 52.96 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.532 2.155 . . . . 0.0 113.105 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.6 tp -79.3 105.45 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.863 0.363 . . . . 0.0 111.707 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.427 HD13 ' HG2' ' A' ' 21' ' ' ARG . 3.7 mm? -63.98 123.53 19.24 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.238 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.52 HG13 ' CH2' ' A' ' 13' ' ' TRP . 76.3 t -56.2 -39.44 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.955 0.407 . . . . 0.0 111.815 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.6 t -72.96 -4.53 32.74 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -99.56 -11.49 20.96 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 120.998 0.428 . . . . 0.0 111.378 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -69.25 135.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-O 120.933 0.397 . . . . 0.0 111.706 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.445 ' OG1' ' HG2' ' A' ' 62' ' ' GLU . 61.3 m -65.15 -50.0 67.67 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.064 0.459 . . . . 0.0 111.597 -179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -155.31 143.09 19.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.284 0.564 . . . . 0.0 111.671 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.4 pt-20 -97.15 86.49 3.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.335 171.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.486 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -75.98 86.45 2.9 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -171.145 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -66.81 139.28 57.77 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.924 172.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.455 ' N ' HD23 ' A' ' 99' ' ' LEU . 2.0 pt? -141.2 145.11 35.21 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.143 0.497 . . . . 0.0 112.088 -177.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.63 131.82 34.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.395 172.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.693 HD21 HD12 ' A' ' 56' ' ' LEU . 88.4 mt -71.14 149.84 46.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.119 0.485 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.82 166.15 3.55 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.639 175.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.84 66.8 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.126 0.489 . . . . 0.0 111.7 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -83.41 -10.93 58.11 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.501 0.667 . . . . 0.0 110.078 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.94 18.89 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.695 -0.684 . . . . 0.0 113.008 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 73.4 t -103.91 123.43 41.07 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 83.04 1.04 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 170.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -80.25 115.37 19.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.433 0.635 . . . . 0.0 112.227 -174.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -88.63 -29.92 19.59 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -47.24 -46.12 21.41 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.414 -0.422 . . . . 0.0 113.556 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -64.93 -40.29 94.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.858 0.361 . . . . 0.0 111.575 177.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -79.02 -24.17 43.86 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -174.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 46.6 mt -93.69 -101.6 0.14 Allowed 'General case' 0 CA--C 1.542 0.658 0 O-C-N 122.321 -0.237 . . . . 0.0 111.287 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 67.76 -33.53 0.22 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 176.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.1 mt 57.7 25.11 11.39 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.323 0.582 . . . . 0.0 110.81 -172.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.54 0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.154 -177.284 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -69.61 96.1 0.91 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.711 173.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 pt -92.2 147.32 5.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.751 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.532 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 43.2 m-85 -119.79 147.44 44.64 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -170.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -126.79 123.59 37.74 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.553 171.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.0 mt -96.56 130.1 45.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.731 0.3 . . . . 0.0 111.468 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -147.71 174.55 11.69 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.811 176.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.4 t -79.79 143.97 33.97 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.797 0.332 . . . . 0.0 111.301 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -55.92 -44.1 78.01 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.68 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.5 -37.72 57.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 111.927 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.56 -41.64 65.54 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.131 0.491 . . . . 0.0 110.893 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -64.45 -49.44 71.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.976 -0.557 . . . . 0.0 112.166 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -58.03 -39.53 78.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.717 0.294 . . . . 0.0 111.559 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -50.64 71.43 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.954 0.407 . . . . 0.0 111.241 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -41.7 89.3 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.163 0.506 . . . . 0.0 111.402 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.402 ' HA ' HG21 ' A' ' 90' ' ' VAL . 24.5 ttmm -63.48 -31.08 72.14 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.08 -40.73 78.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -76.41 -30.55 57.49 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.9 1.14 82.81 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.053 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -141.07 146.56 37.3 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.864 0.364 . . . . 0.0 111.966 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -128.04 99.75 5.61 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.12 0.486 . . . . 0.0 110.283 173.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 3.6 pm0 -71.83 163.89 27.0 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.068 0.461 . . . . 0.0 111.563 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.73 111.46 4.2 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.229 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -67.19 158.39 31.43 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.716 0.293 . . . . 0.0 111.645 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.09 -37.12 43.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.975 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.88 -49.04 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 111.292 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.492 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 8.2 m-20 -62.71 -46.23 89.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.57 -33.24 75.45 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.666 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.29 -37.09 86.25 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.978 0.418 . . . . 0.0 111.78 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -81.42 -51.63 8.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.146 0.498 . . . . 0.0 111.291 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 153.46 71.44 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.416 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 68.64 -176.69 0.21 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.897 0.479 . . . . 0.0 111.597 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.66 103.11 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.302 0.572 . . . . 0.0 111.618 -175.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 8.2 p80 -86.55 106.45 17.55 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.23 0.538 . . . . 0.0 112.218 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -91.55 166.31 12.9 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.1 p -142.72 140.58 31.54 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.902 -0.499 . . . . 0.0 112.163 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.03 157.58 34.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.942 176.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.62 -48.3 8.89 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 114.383 0.513 . . . . 0.0 114.383 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.02 -42.67 89.37 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.188 0.518 . . . . 0.0 111.516 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.88 -40.72 91.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.484 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.41 76.49 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.62 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.736 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 13.1 tm0? -56.58 -50.33 72.27 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -58.06 -56.79 17.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.16 0.505 . . . . 0.0 111.837 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 34.3 m -59.78 -31.24 69.5 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.026 0.441 . . . . 0.0 111.115 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 107' ' ' PRO . . . -62.68 -45.2 93.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.103 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.551 ' HA ' HG13 ' A' ' 106' ' ' VAL . . . -66.0 -33.71 76.42 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.976 0.417 . . . . 0.0 111.855 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.7 -54.05 6.24 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -106.82 -40.7 5.42 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -169.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.2 m-85 -85.64 2.5 44.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.072 0.463 . . . . 0.0 112.186 -173.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.654 ' HA ' ' HD3' ' A' ' 107' ' ' PRO . 45.0 ptt85 -57.25 141.15 47.65 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.547 175.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.48 -17.81 22.58 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.063 -0.589 . . . . 0.0 113.928 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -87.55 97.45 10.86 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.282 0.563 . . . . 0.0 111.287 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.18 54.12 0.97 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.049 0.452 . . . . 0.0 111.894 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -158.8 36.37 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.42 0.628 . . . . 0.0 110.57 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -95.66 155.42 16.75 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.503 -173.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.1 t -123.75 130.27 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.328 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.1 tp -98.4 103.93 15.92 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.639 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.532 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 79.8 mt -86.89 113.9 23.08 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.51 124.45 40.5 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.926 0.393 . . . . 0.0 111.963 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.0 t -124.65 132.01 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 122.788 0.435 . . . . 0.0 110.887 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' A' ' 64' ' ' GLU . 38.7 mt-10 -79.4 66.1 4.76 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . 34.16 -78.41 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.1 mm-40 73.18 132.72 0.04 OUTLIER Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 123.705 0.802 . . . . 0.0 111.779 -170.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 64' ' ' GLU . 12.8 Cg_exo -70.38 26.16 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.574 2.85 . . . . 0.0 114.903 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.85 59.41 4.12 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.387 0.613 . . . . 0.0 111.756 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' A' ' 70' ' ' LEU . . . -58.76 -11.49 10.99 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 115.751 -0.659 . . . . 0.0 114.062 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.81 -42.32 99.67 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.723 0.409 . . . . 0.0 111.831 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -105.61 -30.95 9.17 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.485 HD11 ' HB2' ' A' ' 82' ' ' PRO . 57.5 tp -104.7 101.8 11.41 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.954 0.407 . . . . 0.0 110.762 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -114.04 124.04 51.16 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -69.97 80.09 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.567 0.699 . . . . 0.0 109.132 171.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -100.5 137.39 38.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.236 -169.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -74.81 95.05 2.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.45 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 t -72.74 146.39 46.45 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.088 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 57.22 20.21 5.53 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.843 0.354 . . . . 0.0 111.886 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.03 42.3 99.66 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.351 -176.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.02 -99.69 0.32 Allowed Glycine 0 CA--C 1.531 1.059 0 C-N-CA 120.745 -0.741 . . . . 0.0 114.027 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -80.11 145.1 32.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -86.31 96.0 9.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.978 0.418 . . . . 0.0 111.6 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.7 129.14 39.19 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.485 ' HB2' HD11 ' A' ' 70' ' ' LEU . 33.2 Cg_endo -64.76 100.34 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.515 2.143 . . . . 0.0 112.723 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -93.38 126.88 38.75 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.471 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 tp -92.5 116.05 28.64 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.402 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -84.22 22.32 1.24 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -149.77 156.92 38.64 Favored Pre-proline 0 CA--C 1.54 0.569 0 O-C-N 122.28 -0.262 . . . . 0.0 110.552 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.24 140.91 32.7 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.879 2.386 . . . . 0.0 113.852 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -89.45 98.1 11.58 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.079 0.466 . . . . 0.0 111.061 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.55 132.58 47.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.784 0.326 . . . . 0.0 110.754 176.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.402 HG21 ' HA ' ' A' ' 17' ' ' LYS . 98.2 t -59.7 -39.23 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 120.934 0.397 . . . . 0.0 111.302 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 64.1 m -68.33 -8.96 44.45 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -88.71 -28.17 20.73 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.031 0.444 . . . . 0.0 110.967 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.3 t -66.37 143.4 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.438 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.465 HG22 ' HG3' ' A' ' 95' ' ' ARG . 93.3 m -74.05 -65.08 0.88 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.723 0.297 . . . . 0.0 111.192 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 94' ' ' THR . 37.3 mtp85 -148.15 159.55 43.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.143 0.496 . . . . 0.0 111.853 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -110.37 162.1 14.98 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.703 175.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.9 107.77 3.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.619 0.247 . . . . 0.0 111.474 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -60.2 120.1 9.14 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.011 0.434 . . . . 0.0 110.612 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 100' ' ' ASP . 2.8 tm? -111.27 132.88 54.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.196 -172.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.443 ' N ' HD13 ' A' ' 99' ' ' LEU . 4.2 t70 -124.26 -179.27 4.38 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 120.903 0.382 . . . . 0.0 111.499 -177.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.1 mt -94.66 165.76 12.35 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -173.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.569 ' HB3' ' HB2' ' A' ' 108' ' ' GLN . 5.7 p-10 -106.29 -162.99 0.89 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.109 0.481 . . . . 0.0 111.174 174.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.48 -30.59 68.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -89.72 -3.31 58.26 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.82 19.18 68.42 Favored Glycine 0 CA--C 1.525 0.685 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.956 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.551 HG13 ' HA ' ' A' ' 47' ' ' ALA . 74.2 t -99.8 137.76 20.24 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 122.862 0.465 . . . . 0.0 110.927 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.654 ' HD3' ' HA ' ' A' ' 51' ' ' ARG . 76.0 Cg_exo -51.66 101.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.152 1.901 . . . . 0.0 111.15 171.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 102' ' ' ASP . 8.9 tp-100 -79.26 82.79 5.37 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -167.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.736 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 8.3 mp -83.98 -14.03 51.8 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.785 171.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.14 -41.5 92.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.891 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -83.21 -29.1 28.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 174.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 109' ' ' LEU . 75.8 t60 -76.11 -21.08 57.06 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.891 0.377 . . . . 0.0 111.817 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 72.7 mt . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 121.151 0.5 . . . . 0.0 111.307 -179.687 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.545 ' O ' ' HA ' ' A' ' 62' ' ' GLU . 74.7 p . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.64 0.257 . . . . 0.0 110.849 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.539 HD12 ' HB1' ' A' ' 60' ' ' ALA . 3.8 mm? -83.5 122.86 29.11 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.254 0.549 . . . . 0.0 112.281 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 61' ' ' VAL . 15.6 pt -108.74 143.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.72 171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.504 ' HB3' HD11 ' A' ' 58' ' ' LEU . 40.0 m-85 -120.46 144.53 47.93 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -166.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -150.29 120.13 7.1 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.232 170.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 59.7 mt -92.49 129.74 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.942 0.401 . . . . 0.0 111.928 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -119.51 161.35 20.72 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.067 0.46 . . . . 0.0 111.731 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.5 p -83.51 142.48 30.87 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 166.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -52.22 -37.79 56.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.4 -42.95 67.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.39 -54.65 7.17 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.327 0.584 . . . . 0.0 111.626 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.485 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 50.0 t-105 -68.09 -32.59 73.02 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -64.88 -43.5 92.71 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.58 0.705 . . . . 0.0 110.124 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.26 81.83 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.01 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.67 -45.24 81.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.076 174.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.4 mttm -58.31 -39.21 78.77 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.011 0.434 . . . . 0.0 110.914 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.16 -30.25 71.33 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.141 0.496 . . . . 0.0 111.614 178.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -88.67 -28.02 20.87 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.817 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.42 -4.51 85.24 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.992 -170.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.599 ' HG3' HD23 ' A' ' 89' ' ' LEU . 46.1 ttp180 -146.16 141.56 27.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.462 0.305 . . . . 0.0 111.27 -178.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -103.73 141.4 36.15 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.137 0.494 . . . . 0.0 110.546 171.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -73.78 -165.27 0.27 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.58 -83.64 1.06 Allowed Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.375 -0.917 . . . . 0.0 111.675 172.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.43 ' H ' HD23 ' A' ' 29' ' ' LEU . 30.0 t 163.96 163.31 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.473 1.109 . . . . 0.0 109.426 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.27 57.38 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.244 0.545 . . . . 0.0 110.642 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.0 t -72.72 -55.08 14.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.291 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -51.95 -46.09 64.61 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.95 0.405 . . . . 0.0 111.97 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.43 HD23 ' H ' ' A' ' 25' ' ' SER . 4.0 mm? -73.18 -25.33 60.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.28 86.15 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.147 0.498 . . . . 0.0 110.932 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.39 -39.81 74.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.293 0.568 . . . . 0.0 110.526 170.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.17 -4.51 18.27 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.681 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -165.6 163.05 19.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.824 0.345 . . . . 0.0 110.986 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -72.9 129.29 36.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.171 0.51 . . . . 0.0 111.399 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -124.14 106.71 10.55 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.121 0.486 . . . . 0.0 111.049 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.436 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 72.3 mt -86.54 175.29 8.41 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.173 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.5 p -128.58 153.63 47.03 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.985 0.421 . . . . 0.0 112.067 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.449 ' H ' ' CG ' ' A' ' 41' ' ' GLN . . . -98.36 -174.13 2.75 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.798 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -46.48 -66.12 1.87 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 114.943 0.737 . . . . 0.0 114.943 -173.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.29 -54.99 40.52 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 121.234 0.54 . . . . 0.0 111.926 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' CG ' ' H ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.99 -34.53 76.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.419 -177.21 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.98 -46.59 62.04 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.878 0.37 . . . . 0.0 111.093 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.429 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 8.3 tm0? -61.32 -41.82 97.65 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.2 -53.9 48.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 110.664 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.514 HG23 ' CD1' ' A' ' 49' ' ' TRP . 68.6 m -53.09 -38.68 62.78 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.934 0.397 . . . . 0.0 111.436 177.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.604 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -60.37 -39.01 85.69 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.58 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -82.08 -24.86 34.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.796 178.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.05 -64.79 1.11 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.149 0.5 . . . . 0.0 112.237 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.514 ' CD1' HG23 ' A' ' 45' ' ' THR . 52.9 m95 -91.65 -24.99 19.35 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.436 ' HA ' ' HG3' ' A' ' 53' ' ' GLN . 62.6 m-85 -108.1 17.6 22.13 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 40.1 ttm180 -73.09 115.6 12.61 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.81 29.67 54.12 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.135 -0.555 . . . . 0.0 114.154 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.436 ' HG3' ' HA ' ' A' ' 50' ' ' PHE . 83.5 mm-40 -88.38 -163.74 1.01 Allowed 'General case' 0 N--CA 1.473 0.716 0 O-C-N 122.446 -0.444 . . . . 0.0 111.586 177.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.32 136.08 31.19 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.526 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 55.25 81.31 0.11 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.0 mt -109.09 119.86 40.82 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.473 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 13' ' ' TRP . 21.5 t -104.99 116.61 49.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 120.831 0.348 . . . . 0.0 111.182 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 5' ' ' TYR . 63.4 tp -88.17 111.53 21.72 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.784 0.326 . . . . 0.0 111.18 178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.8 mt -83.45 119.28 24.47 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.802 0.334 . . . . 0.0 110.836 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HB1' HD12 ' A' ' 3' ' ' LEU . . . -116.02 96.25 5.49 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.108 0.48 . . . . 0.0 111.157 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 4' ' ' ILE . 36.5 t -106.08 139.27 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 2' ' ' THR . 24.5 mt-10 -89.81 127.21 35.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.974 -0.454 . . . . 0.0 110.512 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -36.37 -52.33 0.83 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 68.97 133.82 0.04 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 CA-C-O 120.868 0.366 . . . . 0.0 111.653 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.05 53.3 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 122.553 2.169 . . . . 0.0 112.888 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.09 -23.22 67.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.868 0.467 . . . . 0.0 112.201 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 139.48 -88.69 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.325 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -149.81 25.84 0.83 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 122.129 0.966 . . . . 0.0 109.928 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.56 -42.87 98.32 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.544 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 82' ' ' PRO . 17.8 tp -100.25 105.8 17.4 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.049 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -103.56 107.88 18.92 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.901 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 71.7 m95 -73.54 112.53 9.71 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.811 0.338 . . . . 0.0 111.395 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.558 ' HB2' ' CE1' ' A' ' 83' ' ' HIS . 36.5 mt-10 -139.53 134.19 31.86 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.094 0.473 . . . . 0.0 111.065 -178.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.819 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -70.32 96.53 1.14 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.035 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m -69.41 -23.87 63.77 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.856 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -118.95 28.34 8.34 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.719 0.295 . . . . 0.0 111.411 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.24 -80.75 0.72 Allowed Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.974 -0.631 . . . . 0.0 113.393 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.92 49.04 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.911 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -85.25 121.6 28.23 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.575 -0.368 . . . . 0.0 111.679 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.819 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 63.3 mtm180 -85.73 149.55 25.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.005 0.431 . . . . 0.0 111.407 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -136.28 126.01 16.03 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.402 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HB2' HD11 ' A' ' 70' ' ' LEU . 49.0 Cg_endo -68.78 111.94 2.75 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 122.4 2.067 . . . . 0.0 112.495 175.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.558 ' CE1' ' HB2' ' A' ' 73' ' ' GLU . 53.5 m170 -91.45 137.36 32.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.857 0.361 . . . . 0.0 111.789 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -117.17 118.82 33.36 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.844 0.354 . . . . 0.0 110.231 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -96.24 37.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 -164.3 155.13 13.31 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.336 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.531 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 18.2 Cg_endo -58.02 148.36 77.42 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.381 2.054 . . . . 0.0 112.92 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.81 103.39 15.95 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.101 0.476 . . . . 0.0 111.862 -172.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.599 HD23 ' HG3' ' A' ' 21' ' ' ARG . 73.8 mt -66.27 141.19 58.11 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.981 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.22 -36.21 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.274 0.559 . . . . 0.0 110.413 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.4 m -71.88 -0.23 10.79 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.938 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 4.9 tp10 -97.14 -17.43 19.92 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.202 0.525 . . . . 0.0 110.592 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HA ' HG22 ' A' ' 61' ' ' VAL . 57.3 t -78.53 121.55 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.086 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.446 HG21 ' HG3' ' A' ' 62' ' ' GLU . 12.9 m -67.68 -56.42 9.41 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.826 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -139.8 162.62 34.7 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.064 0.459 . . . . 0.0 111.705 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -150.37 158.64 44.38 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.5 177.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.47 122.37 3.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 104.91 6.66 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.91 0.386 . . . . 0.0 110.998 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.575 HD22 ' O ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -131.42 91.82 3.07 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.321 1.057 . . . . 0.0 110.883 177.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -91.13 90.75 7.95 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.832 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.406 HD22 ' O ' ' A' ' 105' ' ' GLY . 54.0 mt 62.65 -170.46 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 173.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -154.73 -164.98 1.94 Allowed 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.4 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.68 -29.81 28.59 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -98.85 4.13 47.46 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.133 -0.354 . . . . 0.0 111.887 -174.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.406 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 78.92 9.31 87.22 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.576 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.7 t -121.92 134.55 24.74 Favored Pre-proline 0 CA--C 1.54 0.581 0 O-C-N 122.596 -0.355 . . . . 0.0 110.809 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.604 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.8 Cg_endo -62.04 100.98 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 121.959 1.773 . . . . 0.0 112.192 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -70.27 78.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.208 0.528 . . . . 0.0 112.346 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.429 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 9.8 mp -65.45 -18.54 65.39 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 176.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.85 -36.37 41.53 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 121.265 -0.493 . . . . 0.0 113.504 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -79.85 -34.83 39.03 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.999 0.428 . . . . 0.0 111.542 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -83.3 -25.69 31.31 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -172.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 mt . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 121.436 0.636 . . . . 0.0 111.135 -179.109 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 63' ' ' ALA . 46.5 p . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 111.398 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 62' ' ' GLU . 88.0 mt -127.9 141.64 51.49 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.148 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 63' ' ' ALA . 23.0 pt -110.66 139.31 34.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.897 0.379 . . . . 0.0 111.19 177.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.416 ' HB3' HD11 ' A' ' 58' ' ' LEU . 66.0 m-85 -122.13 136.2 54.88 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.922 0.391 . . . . 0.0 111.631 -175.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.492 ' HD2' ' HG ' ' A' ' 36' ' ' LEU . 57.3 tttp -138.9 113.42 8.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.001 0.429 . . . . 0.0 111.158 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.3 mt -85.31 140.13 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.8 pt? -161.07 160.71 30.79 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.68 0.276 . . . . 0.0 110.914 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 t -70.23 151.42 45.37 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.786 0.327 . . . . 0.0 111.173 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.05 -28.35 66.37 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.786 0.327 . . . . 0.0 110.322 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.95 99.11 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.234 175.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -67.73 -46.9 70.85 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.248 0.547 . . . . 0.0 110.715 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 30.6 t-105 -60.27 -49.7 76.56 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.467 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.72 -30.72 71.78 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.46 86.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.313 0.577 . . . . 0.0 110.984 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.28 66.86 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.18 0.514 . . . . 0.0 111.371 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HA ' HG11 ' A' ' 90' ' ' VAL . 28.3 ttpp -67.3 -27.43 67.17 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.538 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -46.34 87.96 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.939 0.4 . . . . 0.0 111.272 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.437 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 24.4 pt20 -84.14 -19.86 33.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.432 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.2 -0.35 63.9 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 121.365 -0.445 . . . . 0.0 113.623 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 14.1 ptt180 -140.33 138.3 34.8 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.272 0.558 . . . . 0.0 112.141 -177.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -104.22 95.98 6.33 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.319 173.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -85.15 -1.93 57.45 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.219 0.533 . . . . 0.0 110.626 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.47 149.27 9.51 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.86 -0.609 . . . . 0.0 113.178 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.9 m -73.93 -179.56 3.79 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 122.626 -0.338 . . . . 0.0 110.294 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.91 -47.82 16.24 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -68.53 -55.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -54.74 -51.75 64.66 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.35 -36.76 83.22 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.53 -38.21 77.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.105 0.479 . . . . 0.0 111.472 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -78.49 -33.63 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.168 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.22 -5.92 84.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.241 -0.504 . . . . 0.0 112.207 -175.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 85' ' ' TYR . 31.6 m-85 -124.49 111.93 16.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.473 0.309 . . . . 0.0 110.506 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 64.8 mt -62.32 113.25 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 120.967 0.413 . . . . 0.0 111.199 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -104.21 123.87 48.1 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 112.076 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 3.8 mp -110.48 166.7 10.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.206 -179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.3 m -111.05 116.5 31.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.864 0.364 . . . . 0.0 110.799 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.72 131.35 34.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -175.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.19 -127.81 42.47 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.041 0.776 . . . . 0.0 115.041 170.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.49 -19.21 65.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.84 0.352 . . . . 0.0 111.845 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.54 -29.02 66.51 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 110.716 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.8 -44.39 81.38 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.124 0.487 . . . . 0.0 110.817 175.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.431 HE21 ' HB2' ' A' ' 109' ' ' LEU . 6.3 tp-100 -61.32 -41.05 96.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.077 175.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 31.7 tt0 -60.7 -49.94 75.49 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.696 0.284 . . . . 0.0 110.624 174.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.0 m -57.24 -35.61 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.023 0.44 . . . . 0.0 110.933 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.18 88.16 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.0 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.41 -9.96 57.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 116.31 -0.405 . . . . 0.0 112.018 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 44' ' ' GLU . 33.9 mmtp -90.17 -61.18 1.74 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.101 0.477 . . . . 0.0 111.834 177.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -110.16 -40.12 4.8 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.487 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 99.9 m-85 -96.79 16.94 17.75 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -169.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.17 141.33 41.89 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.056 0.455 . . . . 0.0 111.8 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.14 23.17 65.86 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 114.461 0.545 . . . . 0.0 114.461 175.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.487 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 74.3 mt-30 -98.85 144.61 27.86 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.429 0.615 . . . . 0.0 111.424 177.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.28 142.25 27.82 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.4 81.31 0.18 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.048 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.2 mt -114.36 151.96 32.21 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.15 0.5 . . . . 0.0 111.75 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 49.5 t -130.46 142.81 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.783 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.9 tp -111.39 104.63 13.09 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.944 0.402 . . . . 0.0 110.648 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD22 HG11 ' A' ' 93' ' ' VAL . 84.8 mt -79.9 108.38 13.43 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.913 0.387 . . . . 0.0 111.03 177.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.449 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -108.18 118.02 35.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.889 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.6 t -125.53 143.64 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.437 ' HA ' HD23 ' A' ' 3' ' ' LEU . 46.6 tt0 -72.53 125.36 27.24 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 110.839 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.547 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -82.01 37.61 0.49 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -176.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.81 117.23 39.83 Favored Pre-proline 0 CA--C 1.544 0.748 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -46.28 83.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.118 3.212 . . . . 0.0 114.596 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 66' ' ' LEU . 3.9 mp -54.03 -56.26 19.63 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.687 0.755 . . . . 0.0 109.869 171.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.24 -136.71 2.05 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.834 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 37.8 tt0 -93.51 5.87 50.14 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.297 0.57 . . . . 0.0 111.139 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -81.2 -45.76 15.85 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 tp -81.13 103.07 10.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.989 0.423 . . . . 0.0 110.912 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.654 ' HE3' ' HB2' ' A' ' 73' ' ' GLU . 35.9 ttpt -114.01 117.61 31.81 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.827 0.346 . . . . 0.0 111.912 -177.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -71.57 98.17 1.83 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.096 0.474 . . . . 0.0 109.827 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.654 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -98.53 129.88 45.1 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.23 84.15 6.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.076 0.465 . . . . 0.0 110.021 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.5 m -61.08 106.54 0.61 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -176.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 66.32 -75.51 0.05 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.46 0.704 . . . . 0.0 111.807 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.26 -159.11 33.84 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.774 177.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.84 39.76 2.43 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.344 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.434 ' HB1' ' CE2' ' A' ' 81' ' ' PHE . . . -91.08 108.22 19.72 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.56 -0.377 . . . . 0.0 111.413 -177.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -75.58 92.74 2.94 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.434 ' CE2' ' HB1' ' A' ' 79' ' ' ALA . 65.5 m-85 -117.51 109.45 41.91 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 120.912 0.387 . . . . 0.0 111.91 177.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.628 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 55.2 Cg_endo -68.9 122.43 9.34 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.695 2.263 . . . . 0.0 112.515 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -115.19 120.35 39.44 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.41 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.459 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 16.2 mt -88.62 120.15 29.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.059 0.457 . . . . 0.0 111.7 176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.434 ' HA ' ' HD1' ' A' ' 33' ' ' PHE . 4.4 m-85 -82.86 13.36 3.95 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.351 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -133.54 145.66 57.26 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.212 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -62.91 134.14 45.03 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.356 2.037 . . . . 0.0 111.845 171.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.3 tp -93.42 107.53 19.35 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.4 135.21 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.217 -0.302 . . . . 0.0 110.482 174.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 17' ' ' LYS . 18.9 m -60.53 -30.36 46.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.96 0.409 . . . . 0.0 111.874 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -63.94 -18.02 63.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.598 176.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -90.57 -19.84 23.29 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.634 -177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.463 HG11 HD22 ' A' ' 59' ' ' LEU . 58.9 t -61.99 115.73 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 120.647 0.261 . . . . 0.0 110.998 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.449 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 27.9 m -53.36 -45.38 69.14 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 95' ' ' ARG . 36.8 ttt180 -162.39 146.76 12.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.178 0.513 . . . . 0.0 112.021 174.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -101.78 95.47 6.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.535 0.683 . . . . 0.0 110.199 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -77.91 137.74 38.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.761 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -75.66 149.11 38.23 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.471 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 107' ' ' PRO . 29.5 tp -140.07 133.24 29.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -123.77 171.12 9.87 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.296 0.57 . . . . 0.0 111.861 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.72 149.55 27.19 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.742 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -96.64 -161.4 0.87 Allowed 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.099 0.476 . . . . 0.0 111.41 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.15 -23.57 67.16 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -94.04 -9.99 34.95 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.139 -0.351 . . . . 0.0 111.544 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.01 22.01 60.12 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.242 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.1 t -100.5 130.27 26.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 O-C-N 122.722 -0.281 . . . . 0.0 111.134 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.688 ' HB3' HD21 ' A' ' 99' ' ' LEU . 45.8 Cg_exo -57.72 104.94 0.18 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.369 2.046 . . . . 0.0 112.212 174.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -75.51 100.18 4.45 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.4 mp -100.09 -19.91 16.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.074 176.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.4 -44.85 28.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.245 -176.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -72.0 -30.48 65.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -34.48 72.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 178.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 25.1 mt . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 121.171 0.51 . . . . 0.0 111.934 -175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 80.7 mt -122.23 134.53 54.7 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.929 -174.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.496 HD12 HD13 ' A' ' 36' ' ' LEU . 18.5 pt -121.63 142.44 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 121.02 0.438 . . . . 0.0 111.217 176.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 78.9 m-85 -124.68 145.72 49.52 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.151 0.501 . . . . 0.0 112.263 -175.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 58.6 tttm -135.27 126.94 29.03 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.052 171.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 64.4 mt -93.67 135.62 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.651 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.534 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 pt? -156.47 173.46 16.87 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.627 0.251 . . . . 0.0 110.948 177.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.6 p -77.62 150.74 34.61 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.709 0.29 . . . . 0.0 110.702 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -56.37 -39.36 72.79 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.133 0.492 . . . . 0.0 111.081 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.3 95.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.073 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.59 -44.37 96.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.147 0.498 . . . . 0.0 110.839 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.444 ' CH2' HG13 ' A' ' 90' ' ' VAL . 26.5 t-105 -63.78 -63.81 1.06 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.248 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -29.44 67.65 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.19 -47.51 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.145 0.497 . . . . 0.0 111.095 174.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.9 -30.29 65.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.4 ttmt -56.11 -50.87 69.85 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.321 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.01 80.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.202 0.525 . . . . 0.0 111.358 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -72.44 -24.53 61.22 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.77 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.63 -11.59 13.34 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.261 -177.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -124.86 144.3 50.38 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.508 -0.407 . . . . 0.0 111.965 -176.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.684 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 63.3 t80 -149.19 111.18 4.6 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.067 0.46 . . . . 0.0 111.205 173.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.84 -4.0 44.5 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 122.181 -0.324 . . . . 0.0 111.84 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.63 -176.99 16.91 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.98 -0.628 . . . . 0.0 113.111 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.406 ' O ' HD23 ' A' ' 29' ' ' LEU . 91.4 p -100.3 178.9 4.63 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.759 -0.26 . . . . 0.0 110.356 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.8 -27.79 19.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.137 0.494 . . . . 0.0 111.156 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -68.59 -52.93 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.094 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -58.79 -40.46 84.1 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 25' ' ' SER . 4.5 mm? -65.89 -26.71 67.75 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.476 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.31 -47.07 52.69 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.804 0.335 . . . . 0.0 111.218 175.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -64.74 -34.27 77.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.178 0.514 . . . . 0.0 111.406 174.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 93.57 10.67 58.95 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.077 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -164.18 147.99 9.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.0 mt -64.74 109.09 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.064 0.459 . . . . 0.0 110.482 176.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -74.97 87.67 2.33 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.343 0.592 . . . . 0.0 111.802 -177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.496 HD13 HD12 ' A' ' 4' ' ' ILE . 80.5 mt -84.52 173.46 10.81 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.345 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.459 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 69.0 m -148.69 144.63 27.25 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.947 0.403 . . . . 0.0 111.238 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.5 163.13 28.12 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.342 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -45.55 -47.89 12.32 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.385 -0.436 . . . . 0.0 113.799 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.15 -51.79 55.78 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 5.0 mt-30 -74.67 -32.44 62.22 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.981 0.419 . . . . 0.0 111.358 -175.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.45 -49.56 74.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.16 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.495 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.2 tt0 -67.3 -41.07 85.98 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.377 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.19 -51.91 67.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.965 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -56.37 -38.83 71.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.315 0.579 . . . . 0.0 110.779 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -67.68 -27.68 67.05 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.688 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.34 -41.12 18.59 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -78.53 -42.26 29.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -105.52 -58.18 1.93 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -171.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.519 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 95.5 m-85 -91.11 12.69 19.14 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.51 119.73 12.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.045 0.45 . . . . 0.0 112.19 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.68 -0.49 65.18 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.756 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.506 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 65.7 mt-30 -92.97 116.06 28.7 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 117.158 0.479 . . . . 0.0 111.194 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.34 39.79 1.11 Allowed 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -132.36 17.54 4.45 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.744 0.307 . . . . 0.0 111.195 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.426 ' CD1' ' HB3' ' A' ' 50' ' ' PHE . 14.1 mt -94.54 124.54 38.64 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -171.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.422 ' O ' HD23 ' A' ' 8' ' ' LEU . 95.6 t -98.85 130.1 48.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.084 169.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.466 HD22 HD21 ' A' ' 99' ' ' LEU . 54.3 tp -97.87 109.37 22.14 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 110.672 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.9 mt -81.02 104.65 11.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.831 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -94.55 93.81 7.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.155 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.748 HG22 HG13 ' A' ' 93' ' ' VAL . 22.3 t -112.26 138.18 42.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.966 -176.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 39.3 mt-10 -83.77 156.11 22.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.778 0.323 . . . . 0.0 110.304 173.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.38 59.8 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.914 0.388 . . . . 0.0 111.222 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 3.8 mm-40 -64.79 -51.42 57.77 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.975 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 89.3 Cg_exo -49.86 -56.13 3.43 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.613 2.209 . . . . 0.0 113.97 177.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.648 HD22 HD11 ' A' ' 84' ' ' LEU . 3.2 pp -81.84 -1.12 46.45 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -175.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.23 -155.5 47.55 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.055 -0.593 . . . . 0.0 113.827 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -94.27 14.11 21.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.9 -17.08 64.73 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.062 0.458 . . . . 0.0 111.033 175.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.8 tp -72.46 125.43 27.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.797 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -102.51 121.43 42.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.737 0.303 . . . . 0.0 111.385 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -89.04 131.42 35.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -137.3 103.28 5.05 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.166 0.508 . . . . 0.0 111.845 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -82.47 79.34 8.94 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.053 0.454 . . . . 0.0 110.936 175.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.4 m -68.01 -21.07 65.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.031 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.6 143.52 50.97 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.659 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -51.74 105.14 0.2 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.497 -0.383 . . . . 0.0 113.558 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.83 -30.9 9.37 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.348 -0.454 . . . . 0.0 113.423 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -91.05 99.11 12.2 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.209 0.528 . . . . 0.0 111.674 -177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.499 ' HG2' ' HB2' ' A' ' 74' ' ' ALA . 20.2 mtm180 -91.01 101.26 14.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.532 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -90.86 114.81 62.67 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -173.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.84 131.33 12.13 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.528 2.152 . . . . 0.0 112.432 174.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -127.23 129.12 47.17 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.648 HD11 HD22 ' A' ' 66' ' ' LEU . 7.1 mt -106.09 111.57 24.25 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.412 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -83.53 10.78 8.21 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.725 0.298 . . . . 0.0 111.637 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 86' ' ' ARG . 10.6 ptm180 -137.77 147.61 57.62 Favored Pre-proline 0 N--CA 1.472 0.638 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -176.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.72 135.16 65.3 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.883 2.389 . . . . 0.0 113.519 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.0 tp -94.39 131.75 39.73 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -89.56 136.15 33.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.759 0.314 . . . . 0.0 110.817 177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.537 HG21 ' HA ' ' A' ' 17' ' ' LYS . 95.2 t -57.4 -34.37 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 121.263 0.554 . . . . 0.0 110.83 176.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 59.1 p -67.72 -13.49 62.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.945 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -90.4 -21.42 21.96 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 120.901 0.381 . . . . 0.0 111.396 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.748 HG13 HG22 ' A' ' 61' ' ' VAL . 85.4 t -64.79 145.31 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 72.1 m -85.47 -68.68 0.71 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 74.3 ttt180 -126.17 146.75 49.83 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -110.28 124.78 52.26 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.048 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -139.96 108.19 5.79 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.02 128.96 38.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.818 0.342 . . . . 0.0 110.26 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.466 HD21 HD22 ' A' ' 58' ' ' LEU . 86.8 mt -78.19 90.63 4.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -174.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -78.49 99.94 6.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.156 0.503 . . . . 0.0 110.493 170.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.74 150.82 28.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.189 0.519 . . . . 0.0 111.928 -178.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -138.38 171.22 14.7 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.906 -170.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.56 -83.5 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 177.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -90.65 -11.75 38.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.042 0.448 . . . . 0.0 111.267 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.15 26.68 33.16 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.478 -175.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.73 126.21 36.2 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 122.356 0.262 . . . . 0.0 110.908 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.16 140.56 49.66 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.406 2.071 . . . . 0.0 112.853 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -84.11 87.77 7.16 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.347 0.594 . . . . 0.0 112.208 -175.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 43' ' ' GLN . 11.1 mp -93.96 -4.53 49.57 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.973 -0.454 . . . . 0.0 112.163 176.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.45 74.8 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.611 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 -28.93 61.36 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.324 0.583 . . . . 0.0 111.166 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -72.71 -46.08 55.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.132 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.9 mt . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -172.69 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.12 119.3 31.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.679 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HB ' HD13 ' A' ' 36' ' ' LEU . 26.6 pt -93.69 146.45 6.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 110.85 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.525 ' HB3' HD11 ' A' ' 58' ' ' LEU . 89.0 m-85 -126.14 133.67 51.54 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.121 0.486 . . . . 0.0 112.192 -174.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE3' ' CZ ' ' A' ' 22' ' ' PHE . 47.0 tttm -130.5 117.27 19.37 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.907 174.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pp -84.3 139.37 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.901 0.381 . . . . 0.0 111.21 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.504 ' HB3' ' HZ2' ' A' ' 6' ' ' LYS . 2.2 pt? -165.96 156.47 12.93 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.933 0.397 . . . . 0.0 111.682 177.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.9 m -69.83 140.1 53.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.613 175.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -49.98 -38.34 36.51 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.24 -46.32 62.29 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 176.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.9 -43.87 82.27 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.799 0.333 . . . . 0.0 111.177 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.531 ' CH2' HG23 ' A' ' 90' ' ' VAL . 28.1 t-105 -63.08 -53.14 58.33 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -28.5 69.72 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 122.394 -0.191 . . . . 0.0 111.485 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.68 -52.27 63.95 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.071 0.462 . . . . 0.0 110.777 173.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.97 78.79 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.141 0.496 . . . . 0.0 111.14 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -66.33 -38.03 86.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.11 84.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.172 0.51 . . . . 0.0 110.831 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -71.41 -27.95 63.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.428 0.633 . . . . 0.0 110.613 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.15 4.58 89.79 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.938 -173.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 89' ' ' LEU . 36.1 ttt180 -154.47 139.29 17.14 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -173.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.52 ' CZ ' ' HE3' ' A' ' 6' ' ' LYS . 83.8 t80 -122.44 140.31 52.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -154.85 74.34 0.92 Allowed 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.695 0.759 . . . . 0.0 111.763 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.26 117.17 1.14 Allowed Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.844 -0.616 . . . . 0.0 113.458 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.442 ' N ' ' HB2' ' A' ' 28' ' ' ASP . 70.1 m -70.43 -179.94 2.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 122.638 -0.331 . . . . 0.0 110.842 175.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -46.22 -49.9 16.54 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.211 0.529 . . . . 0.0 111.794 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.8 t -70.68 -51.74 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HB2' ' N ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -54.83 -53.17 58.77 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.839 0.456 . . . . 0.0 112.193 -178.144 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 45.8 tp -62.48 -36.64 83.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.949 0.404 . . . . 0.0 111.125 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -18.29 61.03 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.906 0.384 . . . . 0.0 111.888 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.03 -47.2 7.99 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.878 0.371 . . . . 0.0 111.573 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 150.0 -40.74 0.84 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.217 -0.516 . . . . 0.0 112.825 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -150.56 178.49 9.02 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.706 0.289 . . . . 0.0 111.199 -177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -85.83 125.04 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-O 121.011 0.434 . . . . 0.0 111.549 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -107.65 90.88 3.43 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.375 0.607 . . . . 0.0 111.334 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.625 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 80.9 mt -79.55 170.78 16.06 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.194 0.521 . . . . 0.0 111.805 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -132.23 119.37 20.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.63 101.81 8.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.68 -91.85 0.01 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.489 0.556 . . . . 0.0 114.489 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -45.95 -54.95 7.45 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.025 0.53 . . . . 0.0 111.699 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -63.73 -25.03 68.01 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.732 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.18 -54.6 9.19 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.635 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.566 HE21 ' HB2' ' A' ' 108' ' ' GLN . 52.6 tt0 -67.92 -30.81 70.22 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.684 0.278 . . . . 0.0 111.672 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.25 -46.46 77.04 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.627 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.1 m -60.38 -38.58 84.36 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.063 0.459 . . . . 0.0 110.837 175.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.316 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -77.23 -25.67 51.86 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.928 0.394 . . . . 0.0 111.567 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -82.42 -70.62 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.164 0.507 . . . . 0.0 112.237 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -88.02 -32.64 18.7 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.521 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 88.0 m-85 -101.13 14.36 32.22 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 2.4 tmt_? -58.39 101.91 0.1 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.356 0.598 . . . . 0.0 111.429 -177.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.69 21.72 30.55 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.294 176.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.521 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 76.5 mt-30 -90.94 -179.28 5.44 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.425 0.613 . . . . 0.0 111.438 173.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.5 160.03 35.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -176.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.429 HD22 ' N ' ' A' ' 55' ' ' ASN . 0.9 OUTLIER 61.98 31.07 18.14 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.287 178.002 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.3 mt -76.85 98.32 4.83 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.453 0.644 . . . . 0.0 111.207 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.462 ' O ' HD23 ' A' ' 8' ' ' LEU . 61.0 t -83.7 125.78 40.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.804 176.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 55.2 tp -94.01 101.62 13.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 174.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 91.5 mt -75.17 109.64 8.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.695 0.283 . . . . 0.0 111.194 178.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.27 114.45 28.74 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.563 176.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 93' ' ' VAL . 43.4 t -126.71 127.99 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.53 90.98 2.25 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.519 0.676 . . . . 0.0 111.16 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.69 42.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.307 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 65.7 158.89 0.13 Allowed Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.579 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.9 76.55 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.902 2.401 . . . . 0.0 112.918 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.4 mt -66.98 -65.23 0.71 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.72 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 145.46 -90.65 0.15 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 120.544 -0.836 . . . . 0.0 114.017 177.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -85.02 -42.57 14.74 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -173.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.456 ' HB2' ' HG2' ' A' ' 86' ' ' ARG . 24.7 p-10 -75.45 -41.97 54.43 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 111.805 -173.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.5 tp -85.96 96.49 9.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.219 0.533 . . . . 0.0 109.83 170.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 25.5 tptp -107.54 101.97 11.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.492 -171.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -78.27 103.3 8.12 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HG3' ' HG3' ' A' ' 71' ' ' LYS . 45.3 mt-10 -119.56 107.33 13.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.939 0.4 . . . . 0.0 111.707 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.632 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -77.16 133.57 38.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.345 175.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.1 m -69.3 173.21 5.97 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -51.39 90.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.543 0.687 . . . . 0.0 112.727 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 15.04 60.74 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.767 0.667 . . . . 0.0 114.767 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 165.66 167.74 26.75 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 119.795 -1.193 . . . . 0.0 114.958 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 61.36 97.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.907 0.883 . . . . 0.0 113.332 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 8.7 ptp180 -86.92 103.13 15.01 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.237 0.542 . . . . 0.0 111.199 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -90.28 120.6 69.1 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.002 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.625 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 20.3 Cg_exo -66.31 96.99 0.35 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.677 2.251 . . . . 0.0 111.959 173.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -90.53 112.9 24.75 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.952 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.444 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 56.8 tp -104.95 123.36 47.63 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.254 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -105.36 30.8 5.37 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.54 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' HB2' ' A' ' 69' ' ' ASP . 16.7 mmt85 -132.17 148.68 70.74 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 122.35 0.26 . . . . 0.0 111.554 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.85 123.25 7.82 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.562 2.175 . . . . 0.0 112.283 174.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 tp -90.55 108.53 19.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.008 0.432 . . . . 0.0 111.537 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 21' ' ' ARG . 4.1 mm? -69.26 142.34 54.17 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.74 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.531 HG23 ' CH2' ' A' ' 13' ' ' TRP . 4.4 p -57.08 -30.98 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.438 0.637 . . . . 0.0 110.942 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.2 t -62.92 -28.08 69.81 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.286 178.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 10.0 mm-40 -87.13 -2.81 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.434 ' HA ' HG22 ' A' ' 61' ' ' VAL . 92.5 t -77.82 128.15 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 120.813 0.34 . . . . 0.0 111.412 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 28.7 m -70.5 -61.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.812 0.339 . . . . 0.0 111.377 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 95' ' ' ARG . 24.0 ttt85 -148.5 145.76 28.06 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.28 0.562 . . . . 0.0 111.924 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -111.2 105.58 14.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.874 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -87.67 90.25 8.3 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.941 -0.474 . . . . 0.0 111.837 -178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -71.92 110.09 6.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.896 0.379 . . . . 0.0 111.004 177.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.9 mt -130.64 106.05 8.23 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -72.1 139.87 48.6 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 166.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 105' ' ' GLY . 83.7 mt -78.96 160.29 27.3 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -152.51 165.74 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 63.42 -84.95 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.484 0.713 . . . . 0.0 112.028 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -106.07 -22.63 12.83 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.873 0.844 . . . . 0.0 109.619 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.559 ' O ' HD13 ' A' ' 101' ' ' LEU . . . 120.25 15.05 5.22 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.296 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.551 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 39.8 t -137.32 75.13 46.69 Favored Pre-proline 0 CA--C 1.547 0.862 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.411 ' HD2' HD22 ' A' ' 101' ' ' LEU . 2.9 Cg_endo -83.56 -73.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.482 2.121 . . . . 0.0 109.413 160.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' HE21 ' A' ' 43' ' ' GLN . 75.3 mt-30 56.07 -147.05 0.54 Allowed 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 161.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.478 HD12 ' N ' ' A' ' 109' ' ' LEU . 6.3 mp -64.78 5.65 0.3 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.97 -24.32 13.86 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.645 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -98.69 -28.61 13.45 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 120.993 0.425 . . . . 0.0 111.304 175.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -69.85 -36.77 75.81 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 109' ' ' LEU . 52.8 mt . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 120.894 0.378 . . . . 0.0 111.719 -175.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.662 0.268 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.45 116.28 22.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.003 0.43 . . . . 0.0 111.526 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 17.4 pt -105.77 129.23 59.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.196 0.522 . . . . 0.0 110.55 173.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.529 ' HB3' HD11 ' A' ' 58' ' ' LEU . 6.6 m-85 -110.75 159.22 17.83 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -168.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.525 ' HZ2' ' HG ' ' A' ' 36' ' ' LEU . 6.8 ttpm? -162.11 136.65 6.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.089 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -96.67 141.2 15.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.166 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -153.64 162.66 41.05 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.649 0.261 . . . . 0.0 110.812 174.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -73.69 149.34 41.97 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 19.5 mmm-85 -53.65 -40.44 65.86 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.319 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -23.9 59.95 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 111.831 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -89.32 -48.2 7.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 110.526 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 26.3 t-105 -65.17 -55.59 17.71 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.076 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -33.82 68.57 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.31 98.79 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.053 0.454 . . . . 0.0 110.617 173.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.66 93.85 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.414 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HA ' HG21 ' A' ' 90' ' ' VAL . 52.6 mtmt -63.66 -38.3 90.61 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.514 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.26 -40.99 78.8 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.158 0.504 . . . . 0.0 111.139 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -95.89 1.01 52.73 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.826 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.53 5.03 41.85 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 114.22 0.448 . . . . 0.0 114.22 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HG2' ' CD2' ' A' ' 89' ' ' LEU . 60.4 mtt85 -138.22 130.92 29.48 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.899 -0.765 . . . . 0.0 112.255 -175.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -95.25 111.38 23.24 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -102.81 -10.96 18.66 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -172.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.08 167.82 42.01 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.15 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.2 p -90.39 172.22 8.9 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 122.335 -0.509 . . . . 0.0 111.464 -177.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.37 -32.77 62.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.286 176.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.7 t -63.09 -45.06 99.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.069 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.502 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 7.7 m-20 -56.29 -51.45 68.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.906 0.384 . . . . 0.0 111.125 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.84 -35.48 80.1 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.997 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -35.36 72.2 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.136 0.494 . . . . 0.0 112.067 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.501 ' HB3' ' CE1' ' A' ' 35' ' ' HIS . 12.2 t70 -84.24 -55.65 4.07 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.397 -178.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.34 60.35 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 121.223 -0.513 . . . . 0.0 112.696 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 80.3 m-85 64.39 -171.91 0.18 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.522 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 65.8 mt -55.55 125.46 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -173.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.502 ' CE1' ' HA ' ' A' ' 28' ' ' ASP . 0.7 OUTLIER -87.68 146.59 25.63 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.823 178.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 5.1 mp -142.17 175.67 9.57 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.511 0.325 . . . . 0.0 110.156 167.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.5 m -140.52 159.55 41.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.043 0.449 . . . . 0.0 112.167 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.58 -174.35 3.81 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.531 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -51.36 -72.89 0.44 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.503 -0.379 . . . . 0.0 113.994 -177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -65.78 -32.45 73.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.027 0.442 . . . . 0.0 110.974 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -63.74 -29.51 70.71 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.03 -44.21 93.22 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.063 0.458 . . . . 0.0 110.917 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -66.71 -34.76 78.55 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.92 -52.08 66.58 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.101 0.477 . . . . 0.0 110.492 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 29.4 m -57.77 -38.96 76.36 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.017 0.437 . . . . 0.0 110.938 176.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.51 -50.07 68.83 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.882 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.04 -22.25 66.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -99.94 -43.23 6.46 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -109.78 -19.51 13.12 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -170.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.526 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 92.7 m-85 -131.81 28.48 4.54 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 122.021 -0.425 . . . . 0.0 112.041 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -71.62 119.12 15.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.849 0.357 . . . . 0.0 111.882 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.5 61.09 4.32 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-N 116.199 -0.455 . . . . 0.0 113.703 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.559 ' HB2' HD11 ' A' ' 56' ' ' LEU . 49.8 mt-30 -140.98 159.95 41.11 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 111.662 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.43 175.2 5.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.341 177.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 47.3 m-80 61.26 30.23 19.08 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.166 0.508 . . . . 0.0 111.172 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 53' ' ' GLN . 84.9 mt -92.96 127.23 38.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.39 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.51 122.54 60.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.815 0.34 . . . . 0.0 111.109 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 99' ' ' LEU . 43.7 tp -88.1 98.09 11.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.849 0.357 . . . . 0.0 110.253 174.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 93.9 mt -74.18 107.27 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.823 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.49 100.74 10.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.639 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 95.9 t -109.08 131.62 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.038 0.447 . . . . 0.0 112.155 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -73.55 123.18 23.46 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.779 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.17 -52.2 64.78 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.544 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 1.8 mp0 -59.98 -48.75 93.92 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.544 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 38.1 Cg_exo -62.95 -16.11 52.01 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.153 1.902 . . . . 0.0 113.716 176.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tt -64.79 -65.83 0.62 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.0 -137.04 5.97 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.659 -0.781 . . . . 0.0 114.058 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -103.68 -21.63 13.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -172.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -78.86 30.49 0.2 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -169.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 82' ' ' PRO . 58.6 tp -112.02 140.41 46.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.024 0.44 . . . . 0.0 111.748 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -150.86 128.12 11.27 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.358 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.577 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 76.6 m95 -76.98 86.05 3.5 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.416 0.626 . . . . 0.0 110.504 175.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.2 119.42 33.68 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.468 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.98 64.43 2.46 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.228 0.537 . . . . 0.0 110.89 176.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.9 p -77.74 74.15 4.3 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.07 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.46 HH11 ' HB2' ' A' ' 76' ' ' ARG . 3.1 mtm105 67.32 161.23 0.17 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.31 -63.36 3.97 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.19 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.63 150.09 5.2 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.193 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 68.06 -169.75 0.19 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.857 0.463 . . . . 0.0 111.791 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.577 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 4.4 mpt_? -104.86 122.67 46.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.241 0.543 . . . . 0.0 112.157 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -99.72 110.51 59.16 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.027 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.553 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 51.9 Cg_exo -55.89 111.43 0.77 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.668 2.245 . . . . 0.0 113.17 175.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -97.03 132.46 42.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.031 174.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.522 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 59.1 tp -107.91 111.7 23.94 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.937 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.14 30.04 0.28 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -173.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -160.35 154.13 19.19 Favored Pre-proline 0 N--CA 1.471 0.579 0 O-C-N 122.164 -0.335 . . . . 0.0 111.418 177.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.91 118.39 5.26 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.498 2.132 . . . . 0.0 112.331 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.6 tp -72.72 100.61 2.88 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.102 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.441 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 55.1 mt -58.9 130.06 45.16 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.506 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.543 HG21 ' HA ' ' A' ' 17' ' ' LYS . 96.0 t -56.54 -34.42 41.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 110.876 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.8 p -62.51 -26.75 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.88 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -87.11 -18.49 30.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -64.11 116.24 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.981 0.42 . . . . 0.0 111.254 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.639 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 51.0 p -70.99 -46.5 62.17 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -144.67 145.02 31.54 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -135.39 136.59 41.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.079 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.29 119.63 10.24 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.45 139.14 53.96 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.896 0.379 . . . . 0.0 110.808 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.677 HD21 ' HB2' ' A' ' 58' ' ' LEU . 3.5 mm? -89.02 105.9 18.08 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.54 90.64 6.79 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 168.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.729 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 70.9 mt -89.37 156.52 18.65 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -171.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -144.2 166.25 25.58 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.724 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 54.75 -86.41 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.498 0.719 . . . . 0.0 112.9 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -97.29 -7.36 32.28 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.441 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.729 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 69.63 43.73 66.74 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.609 -175.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.869 ' H ' ' HD2' ' A' ' 107' ' ' PRO . 71.4 t -156.08 -57.85 0.02 OUTLIER Pre-proline 0 N--CA 1.485 1.323 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.869 ' HD2' ' H ' ' A' ' 106' ' ' VAL . 7.4 Cg_endo -40.69 -74.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 124.462 3.442 . . . . 0.0 116.074 -164.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.613 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.3 OUTLIER -48.69 71.5 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -172.084 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 107' ' ' PRO . 1.3 tp -102.06 -31.06 10.81 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.777 -0.577 . . . . 0.0 111.842 170.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.21 -47.1 34.42 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.05 -26.76 68.99 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.837 0.351 . . . . 0.0 111.658 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -82.25 -28.59 31.76 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.907 0.384 . . . . 0.0 110.965 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 41.0 mt . . . . . 0 CA--C 1.535 0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.7 p . . . . . 0 N--CA 1.469 0.494 0 CA-C-O 120.829 0.347 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.497 HD21 ' HB1' ' A' ' 60' ' ' ALA . 2.3 tt -118.11 124.57 48.36 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 -173.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.403 HD12 HD22 ' A' ' 36' ' ' LEU . 28.9 pt -96.58 148.33 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.008 0.433 . . . . 0.0 111.219 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.482 ' HB3' HD11 ' A' ' 58' ' ' LEU . 88.2 m-85 -126.79 103.15 7.37 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -172.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 59' ' ' LEU . 23.2 tptp -89.97 109.5 20.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.832 0.348 . . . . 0.0 111.208 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.1 mt -88.86 137.01 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.214 175.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.506 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 1.7 pt? -166.11 171.13 12.71 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.992 0.425 . . . . 0.0 112.144 -177.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -80.95 148.12 29.96 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.74 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -58.13 -37.08 73.91 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.6 -21.94 65.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.758 0.313 . . . . 0.0 111.736 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HG2' ' HE1' ' A' ' 22' ' ' PHE . 41.6 tt0 -79.24 -51.71 9.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.532 0.682 . . . . 0.0 109.966 175.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.447 ' HB2' HD11 ' A' ' 8' ' ' LEU . 8.1 t-105 -64.01 -61.58 2.18 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.154 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.488 ' HA ' ' HB3' ' A' ' 17' ' ' LYS . 7.0 m-20 -60.69 -26.35 67.06 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.2 -44.45 83.87 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.127 0.489 . . . . 0.0 110.455 172.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.81 63.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.023 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.591 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.1 ttmt -66.02 -42.88 89.05 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.405 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.94 95.18 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.233 0.539 . . . . 0.0 110.753 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.91 -28.46 68.95 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.387 173.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.46 9.58 81.83 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.088 -171.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -150.93 112.25 4.38 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 122.609 -0.348 . . . . 0.0 111.673 -173.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.495 ' HB3' ' HB3' ' A' ' 88' ' ' LEU . 69.4 t80 -89.8 109.2 20.21 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.992 0.425 . . . . 0.0 110.688 175.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -93.97 -7.84 41.75 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.123 0.487 . . . . 0.0 111.129 -178.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.88 -177.7 19.39 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.922 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -104.63 -174.79 2.62 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 122.722 -0.281 . . . . 0.0 110.456 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.38 -43.79 61.99 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.98 0.419 . . . . 0.0 111.876 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.6 -40.85 82.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.865 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.61 -46.0 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.022 0.439 . . . . 0.0 110.919 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.51 -34.03 77.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.277 175.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.99 -44.02 97.61 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 111.027 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -69.48 -32.54 71.5 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.952 0.406 . . . . 0.0 111.136 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.31 -11.51 51.27 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.462 -0.399 . . . . 0.0 112.626 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -153.08 155.09 36.16 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.672 0.389 . . . . 0.0 110.731 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.0 mt -73.23 141.75 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.485 0.659 . . . . 0.0 112.233 -172.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -133.34 100.06 4.72 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.677 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.472 HD12 ' N ' ' A' ' 36' ' ' LEU . 4.8 mp -82.14 -32.74 29.93 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -171.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.2 m 73.22 165.14 0.29 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.885 0.474 . . . . 0.0 111.178 -174.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.37 131.26 20.32 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.08 -104.46 0.07 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 115.184 0.834 . . . . 0.0 115.184 171.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -48.59 -45.32 37.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.192 0.597 . . . . 0.0 111.67 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -68.33 -38.52 81.6 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.54 65.8 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.672 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.0 -39.19 94.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.87 -52.29 57.35 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.22 0.533 . . . . 0.0 110.593 177.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 m -58.68 -33.02 69.67 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.176 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.21 -48.55 81.0 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.778 0.323 . . . . 0.0 111.108 175.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -39.67 93.01 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.882 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -71.96 -43.79 64.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.994 0.426 . . . . 0.0 111.95 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -109.42 -66.05 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -172.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.441 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 98.8 m-85 -76.23 -8.1 56.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -163.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -63.31 2.16 0.42 Allowed 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -173.412 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -149.07 40.05 0.91 Allowed Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.441 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 1.6 mp0 -122.67 174.9 6.81 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.18 0.514 . . . . 0.0 111.67 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.26 161.49 17.14 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.276 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 59.8 36.8 22.12 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.206 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.402 HD12 HD21 ' A' ' 101' ' ' LEU . 89.2 mt -74.56 128.66 36.11 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.166 0.508 . . . . 0.0 111.904 -177.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.2 t -121.86 145.83 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.892 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 5' ' ' TYR . 47.2 tp -114.95 102.25 9.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.15 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 6' ' ' LYS . 90.4 mt -84.68 117.46 23.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.856 0.36 . . . . 0.0 111.414 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HB1' HD21 ' A' ' 3' ' ' LEU . . . -102.88 115.83 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.116 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 50.2 t -126.08 137.32 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 111.657 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -77.83 130.99 37.35 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.753 0.311 . . . . 0.0 110.62 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.61 -28.37 28.53 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.584 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 7.0 mp0 -63.82 -46.99 82.1 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -174.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 7.8 Cg_endo -49.04 -66.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.532 2.155 . . . . 0.0 113.796 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.501 ' H ' HD23 ' A' ' 66' ' ' LEU . 2.4 pt? -60.84 -26.97 67.73 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 58.81 -108.67 1.65 Allowed Glycine 0 CA--C 1.533 1.18 0 N-CA-C 115.104 0.802 . . . . 0.0 115.104 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.9 -27.74 66.97 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -170.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.44 ' HB3' ' HG2' ' A' ' 86' ' ' ARG . 79.0 m-20 -73.56 -7.16 50.77 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.1 tp -120.34 117.51 27.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.71 0.291 . . . . 0.0 110.245 174.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -133.45 134.05 43.08 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.14 0.495 . . . . 0.0 112.162 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -81.24 86.89 6.15 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.668 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -75.39 126.22 30.58 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.92 127.68 33.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.988 0.423 . . . . 0.0 111.358 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 87.3 p -74.11 176.64 6.37 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.396 0.617 . . . . 0.0 112.244 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -65.87 -30.05 70.59 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.972 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.96 14.27 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.779 176.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.55 -49.08 0.53 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.616 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.01 142.28 51.67 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -87.28 150.23 24.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.0 0.429 . . . . 0.0 111.728 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -130.48 124.74 21.25 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.268 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.98 99.5 0.4 Allowed 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.514 2.142 . . . . 0.0 112.357 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -98.25 125.13 43.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.447 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.1 tp -95.46 113.75 25.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.679 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -87.6 22.67 2.17 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.245 0.545 . . . . 0.0 111.824 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HG2' ' HB3' ' A' ' 69' ' ' ASP . 31.3 mmt180 -131.97 140.6 38.67 Favored Pre-proline 0 N--CA 1.468 0.44 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.678 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -59.28 118.0 4.82 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 121.921 1.747 . . . . 0.0 110.987 170.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 22' ' ' PHE . 56.4 tp -67.12 87.78 0.16 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.437 0.637 . . . . 0.0 111.578 -172.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.5 mt -60.22 134.18 56.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.591 HG21 ' HA ' ' A' ' 17' ' ' LYS . 79.3 t -60.09 -31.77 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 121.201 0.524 . . . . 0.0 110.695 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.1 m -71.04 -11.94 61.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.481 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.6 -13.79 22.65 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.955 0.407 . . . . 0.0 111.141 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t -76.53 137.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.861 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.688 HG22 ' HG3' ' A' ' 95' ' ' ARG . 22.8 m -76.3 -66.3 0.82 Allowed 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.688 ' HG3' HG22 ' A' ' 94' ' ' THR . 62.1 mtt85 -141.92 152.79 43.87 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.17 125.35 47.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.045 0.45 . . . . 0.0 109.959 171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.42 155.73 30.24 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.3 0.571 . . . . 0.0 112.537 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -98.7 96.1 7.69 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 1.8 pt? -79.24 149.19 31.95 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.334 0.588 . . . . 0.0 112.26 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -86.53 174.35 9.0 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.844 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.713 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 75.1 mt -133.91 86.51 2.29 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.688 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.669 ' HB3' HE21 ' A' ' 108' ' ' GLN . 24.5 t70 -90.3 166.19 13.46 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -174.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.14 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -135.01 26.95 3.57 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.341 0.591 . . . . 0.0 110.44 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.713 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 102.36 22.34 9.87 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.71 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.8 t -98.02 112.65 62.37 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 122.495 -0.415 . . . . 0.0 110.844 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 109' ' ' LEU . 32.4 Cg_exo -59.39 121.94 10.7 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.674 2.249 . . . . 0.0 112.85 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.669 HE21 ' HB3' ' A' ' 102' ' ' ASP . 87.0 mm-40 -74.59 75.82 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.523 0.677 . . . . 0.0 111.645 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.621 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.9 mp -73.23 -16.08 61.41 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.946 177.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.95 -36.48 51.16 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.039 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -71.58 -22.58 61.71 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.969 0.414 . . . . 0.0 111.498 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -90.6 -14.38 32.55 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 18.2 mt . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.106 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.2 mt -125.49 144.82 50.37 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.416 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.625 HG21 HD11 ' A' ' 70' ' ' LEU . 17.5 pt -118.71 139.88 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-O 121.158 0.504 . . . . 0.0 111.694 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.429 ' HB3' HD21 ' A' ' 58' ' ' LEU . 20.5 m-85 -124.66 147.46 48.53 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.635 -177.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.612 ' HZ3' ' HE2' ' A' ' 22' ' ' PHE . 87.8 tttt -143.7 119.6 10.62 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.794 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.0 mt -92.22 126.55 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 120.908 0.385 . . . . 0.0 110.884 175.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.436 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -143.37 168.19 20.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.598 -0.273 . . . . 0.0 110.979 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG3' ' A' ' 12' ' ' GLU . 29.0 t -71.25 145.34 49.65 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.977 0.418 . . . . 0.0 111.61 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 10' ' ' ARG . 25.5 tpt85 -56.84 -31.28 64.6 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.965 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.25 -47.2 74.52 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.356 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 43.4 mt-10 -60.07 -42.19 94.03 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.233 0.54 . . . . 0.0 110.893 177.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.511 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 20.0 t-105 -70.22 -36.49 74.6 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.582 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.26 -52.02 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.611 0.72 . . . . 0.0 110.465 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.72 -36.56 79.15 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.521 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.16 -46.89 88.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.957 0.408 . . . . 0.0 111.259 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.3 mttm -56.98 -41.56 78.6 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.632 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.9 -45.8 91.38 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.25 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -67.49 -26.44 66.36 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.037 0.446 . . . . 0.0 111.287 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 90' ' ' VAL . . . 87.35 -2.34 86.5 Favored Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.716 -170.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ptt-85 -160.37 168.6 24.87 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.8 0.334 . . . . 0.0 111.325 -176.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.612 ' HE2' ' HZ3' ' A' ' 6' ' ' LYS . 36.6 t80 -136.12 99.65 4.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.252 0.549 . . . . 0.0 110.111 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -94.44 172.89 7.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.091 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -74.97 140.25 26.4 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.688 -175.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.4 m -81.23 167.27 19.78 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 122.789 -0.242 . . . . 0.0 110.422 174.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.93 -32.65 46.76 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.878 0.37 . . . . 0.0 111.252 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.46 -51.31 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.222 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.09 -51.0 63.26 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.47 -32.38 64.92 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.743 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.27 -44.87 51.05 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.987 0.422 . . . . 0.0 111.59 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.97 -34.27 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.19 0.519 . . . . 0.0 111.21 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 138.9 52.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.929 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 65.46 -168.2 0.21 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 122.917 0.487 . . . . 0.0 111.491 -175.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.5 mt -54.26 104.42 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 121.234 0.54 . . . . 0.0 112.117 -173.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -77.58 115.46 17.36 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.367 0.603 . . . . 0.0 111.757 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.518 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 65.1 mt -101.72 -170.27 1.8 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.814 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.8 p -141.31 156.2 45.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -94.63 -177.64 4.28 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.155 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.4 -78.77 0.1 OUTLIER Glycine 0 CA--C 1.53 1.03 0 N-CA-C 114.028 0.371 . . . . 0.0 114.028 -176.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -63.53 -28.48 69.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.202 -0.587 . . . . 0.0 111.651 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.87 -38.75 89.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.586 0.231 . . . . 0.0 111.562 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.25 -48.31 82.28 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.732 0.301 . . . . 0.0 110.948 175.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 17.7 tp60 -59.55 -51.3 70.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.726 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.683 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 11.7 tp10 -62.58 -52.23 64.2 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.216 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 49.8 m -58.62 -38.07 77.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.878 0.37 . . . . 0.0 111.073 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -61.73 -44.61 96.59 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.823 0.344 . . . . 0.0 111.334 176.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.94 -25.6 64.64 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.683 ' HE2' ' HG3' ' A' ' 44' ' ' GLU . 54.5 mttm -88.44 -51.88 5.48 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -105.48 -43.02 5.06 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -169.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.511 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.1 m-85 -85.06 -2.07 57.57 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -174.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.8 ptt85 -62.36 130.96 47.63 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.087 0.47 . . . . 0.0 111.58 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.39 -7.83 80.53 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.267 -0.492 . . . . 0.0 113.457 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.442 ' HB2' HD11 ' A' ' 56' ' ' LEU . 70.4 mt-30 -91.36 116.75 29.09 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.229 -0.571 . . . . 0.0 111.022 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.66 155.76 19.41 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.897 0.38 . . . . 0.0 111.391 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 63.37 73.0 0.46 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.47 0.652 . . . . 0.0 111.435 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 53' ' ' GLN . 97.1 mt -120.76 154.3 35.85 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.804 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.1 t -128.78 138.74 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.939 0.4 . . . . 0.0 111.257 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 5' ' ' TYR . 5.9 tt -112.95 108.69 17.71 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.973 0.416 . . . . 0.0 109.941 176.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.15 110.98 17.17 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.205 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.444 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.83 117.38 34.22 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.51 130.88 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 120.96 0.409 . . . . 0.0 111.667 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.17 108.52 14.89 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.053 0.454 . . . . 0.0 110.848 176.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.83 52.94 2.61 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -169.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.526 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 44.5 mt-10 -80.92 -58.32 0.53 Allowed Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.914 -0.491 . . . . 0.0 111.975 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 83.1 Cg_endo -76.68 -38.72 0.86 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 122.07 1.847 . . . . 0.0 113.338 -178.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.586 ' H ' HD23 ' A' ' 66' ' ' LEU . 2.5 pt? -98.57 21.66 10.95 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.185 0.517 . . . . 0.0 111.561 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.52 -11.14 40.11 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 115.0 0.76 . . . . 0.0 115.0 -174.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -121.5 4.69 10.16 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 117.753 0.777 . . . . 0.0 111.49 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.589 ' HB3' ' HD3' ' A' ' 86' ' ' ARG . 2.3 m-20 -80.45 -1.94 43.67 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 111.008 175.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.625 HD11 HG21 ' A' ' 4' ' ' ILE . 2.7 pt? -137.07 163.83 29.85 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.026 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -123.79 126.22 46.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.997 0.427 . . . . 0.0 111.92 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -80.29 82.73 6.28 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.174 0.512 . . . . 0.0 110.315 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -77.94 98.24 5.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.328 0.585 . . . . 0.0 112.178 -175.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -92.16 67.72 5.05 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.546 0.689 . . . . 0.0 110.006 172.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 79.8 p -129.37 -73.13 0.57 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.612 -176.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -70.27 102.38 2.11 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.773 0.32 . . . . 0.0 111.191 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.91 -19.4 41.16 Favored Glycine 0 CA--C 1.525 0.698 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.046 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.65 -33.74 4.85 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 121.279 -0.486 . . . . 0.0 113.987 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -77.72 169.46 18.26 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.113 0.483 . . . . 0.0 112.015 -178.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -83.28 110.19 17.89 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -115.26 105.71 52.12 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.518 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 44.7 Cg_endo -71.76 114.26 3.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.564 2.176 . . . . 0.0 112.694 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -108.74 118.6 37.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.879 175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.413 HD22 ' H ' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -90.94 116.07 28.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.069 0.462 . . . . 0.0 110.43 178.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -87.14 9.32 20.31 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.023 0.44 . . . . 0.0 111.771 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 69' ' ' ASP . 35.1 mtp85 -129.52 149.41 72.79 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.065 -176.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.62 132.14 28.04 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.635 2.224 . . . . 0.0 112.701 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 93' ' ' VAL . 10.1 tt -89.6 106.32 18.38 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.9 mt -74.46 138.55 43.31 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.256 -0.277 . . . . 0.0 110.369 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 20' ' ' GLY . 26.2 m -61.19 -31.46 50.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.862 -0.524 . . . . 0.0 111.763 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 84.9 p -67.47 -12.28 59.92 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.67 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -90.65 -21.57 21.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.578 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 88' ' ' LEU . 48.7 t -62.21 118.15 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.694 0.283 . . . . 0.0 111.687 -176.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 87.8 m -58.45 -56.38 22.9 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.017 0.437 . . . . 0.0 111.125 177.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -145.0 144.63 31.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.219 0.533 . . . . 0.0 111.483 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -116.5 103.53 10.51 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.39 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -91.03 107.39 19.17 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.761 0.315 . . . . 0.0 111.827 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.65 111.35 4.74 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.08 119.33 9.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.471 0.653 . . . . 0.0 112.43 -173.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -71.73 -42.17 67.62 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.614 -176.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.4 mt 68.27 132.79 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.246 0.618 . . . . 0.0 111.836 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -140.09 162.29 35.59 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.272 0.558 . . . . 0.0 111.896 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.19 -79.82 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -105.21 11.97 32.44 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -171.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 71.89 30.08 66.3 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.026 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.78 142.3 26.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.123 0.569 . . . . 0.0 109.999 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.441 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 13.0 Cg_exo -71.99 103.72 1.53 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 122.13 1.887 . . . . 0.0 112.68 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -80.88 80.83 7.28 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.16 0.505 . . . . 0.0 111.643 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.9 mp -66.11 -26.67 67.56 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 122.048 -0.408 . . . . 0.0 110.864 174.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.28 -23.05 46.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.338 -0.458 . . . . 0.0 113.333 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -98.76 -11.73 21.61 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 122.463 -0.433 . . . . 0.0 111.584 175.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -88.8 -37.95 15.02 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.808 0.337 . . . . 0.0 111.502 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 14.0 mt . . . . . 0 CA--C 1.541 0.62 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.301 -175.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.97 123.54 46.06 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.864 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.619 HD12 HD13 ' A' ' 36' ' ' LEU . 13.1 pt -108.71 153.75 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -177.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 94.9 m-85 -131.85 163.11 28.99 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.583 0.706 . . . . 0.0 112.536 -176.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HZ3' HD23 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -157.95 115.56 3.0 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 177.198 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.5 mt -102.38 127.43 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.613 0.244 . . . . 0.0 111.339 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.444 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -151.92 166.0 32.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.916 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 m -69.46 146.71 51.74 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 122.3 -0.25 . . . . 0.0 111.67 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -57.25 -52.2 66.3 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.46 -39.76 64.73 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.162 0.506 . . . . 0.0 111.409 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -67.11 -36.33 81.69 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.847 177.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -64.28 -48.49 75.48 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.221 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.28 -30.22 69.32 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.53 0.205 . . . . 0.0 111.375 176.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.05 -60.19 3.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.989 0.423 . . . . 0.0 110.882 174.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.21 -35.22 69.37 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 111.266 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HA ' HG21 ' A' ' 90' ' ' VAL . 26.5 ttpp -69.92 -31.87 69.87 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.395 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.87 -21.7 61.62 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.303 0.573 . . . . 0.0 111.037 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -87.74 -23.13 24.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.971 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.95 -2.74 63.64 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 121.275 -0.488 . . . . 0.0 112.117 -172.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.568 ' HG3' HD23 ' A' ' 89' ' ' LEU . 54.0 ttp180 -143.13 141.53 31.23 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.006 0.431 . . . . 0.0 111.663 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -110.16 109.67 20.27 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.627 176.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -122.56 90.33 3.28 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.615 0.721 . . . . 0.0 112.226 179.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA2' ' HB2' ' A' ' 28' ' ' ASP . . . 65.98 101.62 0.02 OUTLIER Glycine 0 CA--C 1.533 1.194 0 N-CA-C 115.671 1.028 . . . . 0.0 115.671 171.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.2 m -76.75 177.9 7.22 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 167.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.06 -46.45 33.5 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.112 0.482 . . . . 0.0 112.294 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.0 t -70.06 -44.59 78.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.739 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HA2' ' A' ' 24' ' ' GLY . 5.2 m-20 -64.35 -27.5 69.06 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.87 0.367 . . . . 0.0 111.481 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.48 -36.3 73.77 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.312 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.16 -49.0 77.6 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.741 172.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.04 -28.17 69.4 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.623 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.82 -45.96 3.09 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -175.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -116.68 145.26 43.56 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -52.8 114.67 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -176.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -90.45 107.96 19.48 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.813 0.816 . . . . 0.0 110.532 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.684 HD23 ' HZ3' ' A' ' 6' ' ' LYS . 35.0 mt -89.45 54.88 3.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.522 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -45.87 107.12 0.09 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.897 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -103.31 147.05 27.56 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.6 -113.43 3.08 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 115.541 -0.754 . . . . 0.0 114.667 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -54.89 -47.67 74.02 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -59.81 -39.97 86.84 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.757 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.36 -56.55 19.09 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.939 0.399 . . . . 0.0 111.445 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -61.74 -49.7 75.36 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.8 -22.38 66.98 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -176.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.0 m -81.0 -40.5 24.22 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.21 0.529 . . . . 0.0 110.311 171.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.57 74.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.278 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.58 -24.57 67.62 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -100.31 -56.54 2.33 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.129 0.49 . . . . 0.0 111.971 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -78.6 -37.72 41.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -109.25 8.85 25.9 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -172.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.25 136.62 58.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.979 0.419 . . . . 0.0 111.654 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.66 -26.02 16.14 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.404 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -85.82 116.23 23.95 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 122.534 -0.392 . . . . 0.0 111.424 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB1' ' HA ' ' A' ' 100' ' ' ASP . . . -103.89 -0.46 29.05 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -92.03 15.78 12.59 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.65 159.08 18.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -177.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.7 143.34 38.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.988 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.0 tt -98.68 133.57 42.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.796 0.331 . . . . 0.0 110.967 175.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.4 mt -104.94 130.01 53.21 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.322 0.249 . . . . 0.0 110.975 177.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -118.84 122.19 41.78 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.721 0.296 . . . . 0.0 110.915 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.2 t -133.84 137.88 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.735 0.302 . . . . 0.0 111.562 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -77.19 127.65 32.99 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 170.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -52.36 64.12 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -175.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.481 ' HG3' ' HD2' ' A' ' 65' ' ' PRO . 35.0 tt0 69.43 141.52 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.921 0 C-N-CA 122.885 0.474 . . . . 0.0 110.874 -173.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 24.4 Cg_endo -61.59 77.45 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.575 2.184 . . . . 0.0 112.65 177.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.4 mt -72.64 -59.38 2.75 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.661 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.78 -118.71 0.79 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.365 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -130.38 18.26 5.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 122.381 -0.482 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -79.37 -36.6 39.04 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.83 0.348 . . . . 0.0 111.554 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -81.55 101.82 10.21 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.254 0.549 . . . . 0.0 110.804 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HD3' ' CE1' ' A' ' 85' ' ' TYR . 48.9 mtpt -95.67 109.87 22.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.136 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.535 ' CZ3' ' HG3' ' A' ' 82' ' ' PRO . 78.1 m95 -74.25 73.38 1.8 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.717 0.77 . . . . 0.0 109.256 167.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -90.15 117.5 28.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.246 -169.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -86.71 132.8 33.77 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 176.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.2 t -145.52 178.89 7.79 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 62.97 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.903 0.481 . . . . 0.0 111.7 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.32 23.65 0.44 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.38 -158.64 26.98 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.982 -0.447 . . . . 0.0 111.982 -176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 62.87 111.42 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.253 0.549 . . . . 0.0 112.371 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 -82.16 93.4 7.05 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.938 0.399 . . . . 0.0 111.63 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -78.86 113.98 39.99 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.515 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 12.3 Cg_exo -69.61 88.31 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.464 2.109 . . . . 0.0 112.494 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -88.52 106.49 18.32 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.5 tp -92.05 122.65 34.75 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.05 0.453 . . . . 0.0 111.229 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 71' ' ' LYS . 2.0 m-85 -86.43 21.18 2.18 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.471 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 12.1 mtm180 -132.6 143.15 47.55 Favored Pre-proline 0 N--CA 1.473 0.709 0 O-C-N 122.048 -0.408 . . . . 0.0 111.278 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.41 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 21.9 Cg_exo -65.87 111.12 1.85 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.299 1.999 . . . . 0.0 111.447 172.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.45 114.12 10.23 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.802 -170.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.568 HD23 ' HG3' ' A' ' 21' ' ' ARG . 71.0 mt -73.26 142.28 47.24 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.745 0.307 . . . . 0.0 111.155 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.622 HG21 ' HA ' ' A' ' 17' ' ' LYS . 86.1 t -59.08 -31.39 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.304 0.573 . . . . 0.0 111.06 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.6 p -73.79 -10.83 60.08 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.17 176.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 89' ' ' LEU . 55.3 mt-10 -89.22 -18.31 27.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.852 0.358 . . . . 0.0 110.556 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.1 t -72.52 127.45 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.409 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 89.0 m -73.33 -65.22 0.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.1 ptt-85 -148.18 154.56 40.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.812 0.339 . . . . 0.0 111.767 -174.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.62 174.19 5.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.043 0.449 . . . . 0.0 110.768 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HB1' ' CE1' ' A' ' 112' ' ' HIS . . . -152.72 98.17 2.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.808 0.337 . . . . 0.0 111.601 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.08 136.56 39.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.511 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.506 HD23 ' N ' ' A' ' 99' ' ' LEU . 1.5 pt? -141.06 97.52 3.19 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.635 0.731 . . . . 0.0 112.172 -177.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.439 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t70 -84.64 127.93 34.34 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.498 173.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -155.28 -171.54 3.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.05 0.452 . . . . 0.0 111.932 -171.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -142.48 -168.07 2.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.755 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.18 -0.73 15.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -175.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -133.56 -31.79 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -54.25 -53.41 37.9 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 110.531 -1.027 . . . . 0.0 110.531 164.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' HD2' ' A' ' 107' ' ' PRO . 2.1 t 65.68 146.04 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 170.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.553 ' HD2' HG13 ' A' ' 106' ' ' VAL . 24.1 Cg_exo -33.31 99.37 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.25 0 C-N-CA 123.756 2.97 . . . . 0.0 114.613 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -76.26 78.66 3.04 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.609 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.5 mp -100.19 -16.89 17.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.3 -27.96 48.65 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.246 -0.502 . . . . 0.0 113.921 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.95 -9.79 33.01 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . 0.419 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 82.3 m-70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 23.2 mt . . . . . 0 CA--C 1.538 0.49 0 CA-C-O 121.017 0.437 . . . . 0.0 111.38 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.5 t . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.78 0.324 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 89.2 mt -115.64 122.54 45.91 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.878 0.37 . . . . 0.0 110.817 177.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 36' ' ' LEU . 23.6 pt -102.51 149.38 7.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.033 0.444 . . . . 0.0 111.458 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.443 ' HB3' HD11 ' A' ' 58' ' ' LEU . 80.3 m-85 -142.65 121.67 12.85 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.772 -174.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HD2' HD23 ' A' ' 36' ' ' LEU . 79.6 tttt -110.48 125.29 53.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.921 0.391 . . . . 0.0 110.896 176.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.461 HD11 HD21 ' A' ' 109' ' ' LEU . 65.9 mt -98.29 132.49 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.342 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.439 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.2 pt? -145.78 171.06 15.33 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.687 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.4 p -77.85 148.92 34.43 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.127 0.489 . . . . 0.0 111.324 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -56.72 -36.1 69.31 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.5 -49.03 75.9 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.3 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -70.0 -40.85 75.03 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.505 ' HZ2' ' HG2' ' A' ' 96' ' ' GLU . 41.3 t-105 -63.4 -40.01 96.06 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.509 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 4.7 t0 -62.93 -43.84 97.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.246 0.546 . . . . 0.0 110.039 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.08 -46.08 85.86 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.513 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.62 89.49 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.208 0.527 . . . . 0.0 111.07 175.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.509 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 25.5 ttpp -60.75 -44.14 97.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.984 175.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -38.4 89.89 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.196 0.522 . . . . 0.0 111.352 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.39 -29.13 61.41 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.442 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.1 5.05 89.11 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.736 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.418 HH21 ' CD ' ' A' ' 23' ' ' GLU . 57.2 mtp180 -146.28 134.9 22.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.791 0.436 . . . . 0.0 111.278 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -102.11 98.44 8.61 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.449 0.643 . . . . 0.0 110.008 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.418 ' CD ' HH21 ' A' ' 21' ' ' ARG . 34.8 mm-40 -80.49 -176.05 5.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.23 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.12 116.81 8.86 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.176 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.4 p -74.21 -174.17 1.87 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.498 -0.413 . . . . 0.0 110.681 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.74 -37.21 65.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.01 0.433 . . . . 0.0 111.12 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.3 t -77.94 -47.22 25.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.11 0.481 . . . . 0.0 111.705 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.65 -43.1 99.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.174 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.63 -28.63 62.87 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.88 73.03 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.046 0.45 . . . . 0.0 110.909 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.51 -31.11 53.28 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.375 173.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.16 -12.45 48.59 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.365 -0.379 . . . . 0.0 112.531 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -141.55 151.51 43.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.997 0.519 . . . . 0.0 111.01 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.416 HG23 ' NZ ' ' A' ' 6' ' ' LYS . 55.1 mt -69.85 135.27 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -171.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -87.2 145.95 26.2 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.899 173.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.613 HD11 HD12 ' A' ' 84' ' ' LEU . 78.5 mt -134.64 -69.76 0.51 Allowed 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.552 ' OG ' ' HB2' ' A' ' 41' ' ' GLN . 39.9 t 76.89 165.25 0.25 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.484 0.714 . . . . 0.0 112.343 -175.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' ILE . . . -111.05 176.63 4.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.532 176.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.27 -44.19 7.68 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.441 0.536 . . . . 0.0 114.441 -177.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.06 -66.27 0.41 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.008 0.432 . . . . 0.0 111.929 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.552 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 20.8 mt-30 -76.11 -15.61 60.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -176.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.96 64.88 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.777 0.322 . . . . 0.0 110.686 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.568 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 13.3 tt0 -66.74 -35.73 80.8 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.217 175.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.646 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 63.7 mm-40 -55.21 -60.94 2.69 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.998 0.428 . . . . 0.0 110.724 173.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -54.71 -40.13 68.91 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.449 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -61.71 -41.04 97.08 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.466 176.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.85 -37.56 64.76 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.646 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 48.8 mttm -78.98 -61.52 1.99 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.02 0.438 . . . . 0.0 111.9 -178.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.55 -40.67 16.04 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -107.57 35.39 3.1 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 122.303 -0.248 . . . . 0.0 111.617 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -24.01 -51.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.711 1.204 . . . . 0.0 113.955 -174.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.53 50.14 0.46 Allowed Glycine 0 CA--C 1.525 0.695 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.731 177.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.564 ' HB2' HD21 ' A' ' 56' ' ' LEU . 77.6 mm-40 -77.46 124.74 28.3 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.544 -0.386 . . . . 0.0 111.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.46 68.25 4.85 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.128 0.489 . . . . 0.0 112.095 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -175.39 22.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.303 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 53' ' ' GLN . 42.1 mt -84.21 141.02 31.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.396 0.617 . . . . 0.0 112.288 -173.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.1 t -123.47 128.59 74.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.381 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.443 HD11 ' HB3' ' A' ' 5' ' ' TYR . 52.7 tp -95.82 114.03 25.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.299 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.2 mt -91.56 105.8 18.01 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.805 0.336 . . . . 0.0 110.96 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.69 112.73 24.66 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.479 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 93' ' ' VAL . 20.7 t -130.59 137.36 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.949 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.83 133.74 39.26 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 173.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.37 -74.09 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 59.18 161.52 0.09 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -59.73 -62.13 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.119 1.879 . . . . 0.0 112.182 169.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.3 pp 34.61 33.71 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.98 121.42 4.91 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.849 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.83 -1.12 0.56 Allowed 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -61.02 -25.43 66.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.761 0.315 . . . . 0.0 111.329 174.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.79 106.14 16.81 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.911 0.386 . . . . 0.0 110.295 174.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 73' ' ' GLU . 78.3 tttt -125.86 128.39 47.55 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -174.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 75.0 m95 -79.38 105.6 10.81 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.213 -0.304 . . . . 0.0 111.238 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG2' ' HE2' ' A' ' 71' ' ' LYS . 44.3 mt-10 -118.46 131.08 56.27 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 111.784 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.457 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -94.26 115.68 27.96 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.2 t -75.89 173.61 10.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.24 0.543 . . . . 0.0 112.168 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -64.94 98.03 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.476 0.655 . . . . 0.0 111.599 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 147.49 -33.13 1.33 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.134 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.23 -28.23 3.67 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.45 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -57.73 123.98 17.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.457 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 68.4 mtm180 -97.6 96.85 8.57 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.279 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 68.3 m-85 -104.95 112.81 65.26 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 27.9 Cg_endo -64.16 108.3 0.94 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.079 1.853 . . . . 0.0 111.748 173.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -90.47 126.15 35.81 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.348 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -96.45 112.69 24.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.419 178.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -78.69 3.29 16.87 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 120.794 0.331 . . . . 0.0 111.616 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.431 ' HB3' HD22 ' A' ' 84' ' ' LEU . 7.1 tpp180 -119.29 140.1 28.54 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 122.929 0.492 . . . . 0.0 110.635 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -53.19 139.08 63.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.45 2.1 . . . . 0.0 112.484 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.407 HD12 HD21 ' A' ' 36' ' ' LEU . 6.0 tt -88.81 107.11 18.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.188 0.518 . . . . 0.0 111.049 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.547 ' HB2' ' HG2' ' A' ' 92' ' ' GLU . 50.8 mt -79.35 130.79 35.78 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.54 -22.88 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 O-C-N 121.845 -0.534 . . . . 0.0 111.808 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 58.6 m -66.97 -15.97 64.05 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.532 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.547 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 51.4 mm-40 -81.51 -18.32 45.51 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.546 ' HA ' HG22 ' A' ' 61' ' ' VAL . 59.6 t -70.87 117.96 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 120.961 0.41 . . . . 0.0 111.879 -176.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.5 m -60.8 -46.95 88.5 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.966 0.413 . . . . 0.0 111.33 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -159.19 148.52 18.57 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.748 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.505 ' HG2' ' HZ2' ' A' ' 13' ' ' TRP . 0.4 OUTLIER -134.02 154.84 50.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.657 0.265 . . . . 0.0 111.14 177.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -166.82 150.05 6.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.878 0.37 . . . . 0.0 111.737 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -66.27 123.73 20.75 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.552 HD21 HD11 ' A' ' 109' ' ' LEU . 54.2 tp -78.31 128.55 33.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.585 -174.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -92.26 156.34 17.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.971 0.415 . . . . 0.0 111.306 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 73.7 mt -100.31 174.69 6.01 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.241 0.543 . . . . 0.0 112.016 -175.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.481 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 31.4 t70 -100.95 173.27 6.56 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.346 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.07 -33.16 37.97 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.948 0.404 . . . . 0.0 111.601 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.83 -28.98 24.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.254 0.549 . . . . 0.0 110.633 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.04 -23.78 6.46 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.605 -174.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.3 t -59.24 119.21 36.93 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.448 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 33.9 Cg_exo -59.19 111.32 0.88 Allowed 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 122.538 2.159 . . . . 0.0 112.817 177.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.481 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 85.2 mm-40 -88.79 84.86 6.68 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.299 0.571 . . . . 0.0 112.355 -175.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 43' ' ' GLN . 7.5 mp -81.94 -35.64 28.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.495 177.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.76 -34.73 29.62 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.949 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.47 -33.38 21.87 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.876 0.369 . . . . 0.0 111.415 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.65 -27.13 65.72 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 48.9 mt . . . . . 0 N--CA 1.469 0.512 0 CA-C-O 121.196 0.522 . . . . 0.0 112.108 -175.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 61.6 m . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 121.099 0.476 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -76.75 111.83 12.69 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.9 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 36' ' ' LEU . 6.9 pt -96.32 135.14 31.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.08 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 71.7 m-85 -116.09 155.96 27.24 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -172.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 63.0 tttp -154.82 129.65 9.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.627 174.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.55 120.62 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 120.605 0.241 . . . . 0.0 110.931 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.499 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -135.49 158.48 44.26 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.838 0.351 . . . . 0.0 111.237 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 p -69.92 151.36 45.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.211 0.529 . . . . 0.0 112.088 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -58.81 -60.69 3.44 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.54 -33.79 64.12 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -69.41 -38.82 78.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.897 0.379 . . . . 0.0 111.088 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 44.1 t-105 -64.67 -46.48 82.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.812 0.339 . . . . 0.0 110.77 174.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.6 -37.06 84.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 176.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.528 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -61.76 -53.63 53.43 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.968 0.413 . . . . 0.0 110.828 175.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.32 -37.64 78.28 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.162 0.506 . . . . 0.0 111.311 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HA ' HG21 ' A' ' 90' ' ' VAL . 25.7 ttpp -67.42 -33.74 75.8 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.05 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.04 -36.43 79.91 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.267 0.556 . . . . 0.0 110.676 173.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 76.2 mm-40 -74.36 -29.45 61.57 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.0 175.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.79 2.97 74.62 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 115.993 -0.548 . . . . 0.0 112.587 -175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -154.19 129.0 9.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 111.62 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 65.1 t80 -95.92 97.9 9.99 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.172 0.51 . . . . 0.0 110.204 173.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.25 -36.67 71.85 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.132 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.44 157.7 7.66 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.533 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -84.47 170.05 13.89 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.396 0.279 . . . . 0.0 110.916 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.86 -43.8 69.84 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.074 0.464 . . . . 0.0 111.405 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.9 t -61.82 -32.37 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.503 176.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.527 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 71.1 m-20 -72.89 -49.89 27.05 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.943 0.401 . . . . 0.0 111.226 179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.43 -34.69 78.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.809 0.337 . . . . 0.0 111.618 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.52 78.6 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.083 0.468 . . . . 0.0 111.485 176.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.74 -38.93 37.65 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.008 0.432 . . . . 0.0 111.53 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.86 -20.55 28.98 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.887 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -129.59 160.23 33.91 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.685 0.394 . . . . 0.0 110.48 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.556 ' O ' HG22 ' A' ' 34' ' ' ILE . 32.7 mt -75.86 12.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 32.0 m-70 49.59 88.74 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.654 -0.654 . . . . 0.0 112.356 -178.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 4' ' ' ILE . 73.0 mt -117.45 155.88 28.93 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 122.156 -0.34 . . . . 0.0 110.628 176.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -141.9 149.03 39.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.67 -179.9 4.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.143 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -48.3 -63.3 3.76 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 121.463 -0.399 . . . . 0.0 114.054 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -55.6 -50.03 71.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.248 0.546 . . . . 0.0 111.674 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -60.89 -33.42 73.08 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.862 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.76 -44.74 66.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.012 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.48 -35.79 81.93 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.181 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.14 -56.87 11.78 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.895 0.378 . . . . 0.0 110.296 174.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 97.0 m -55.02 -31.62 61.2 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.274 176.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.83 -58.73 4.94 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.899 0.38 . . . . 0.0 111.176 175.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.81 69.01 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -87.54 -45.62 10.3 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -112.39 -52.11 2.8 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.587 ' HB3' HE22 ' A' ' 53' ' ' GLN . 97.1 m-85 -102.45 60.18 0.82 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.677 0.751 . . . . 0.0 111.521 -170.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -106.4 3.37 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.43 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -113.9 60.06 0.38 Allowed Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.916 171.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.587 HE22 ' HB3' ' A' ' 50' ' ' PHE . 6.8 mm-40 -73.69 110.07 7.7 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.9 -66.82 1.02 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -137.1 61.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.549 0.69 . . . . 0.0 110.902 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.416 HD21 ' OE1' ' A' ' 53' ' ' GLN . 0.9 OUTLIER -130.19 -179.96 5.54 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.171 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.9 t -134.86 147.37 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.98 0.419 . . . . 0.0 111.675 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 70.2 tp -101.32 108.88 20.63 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.657 174.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.8 mt -84.75 147.84 26.66 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.887 0.375 . . . . 0.0 111.701 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.529 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -141.39 131.48 24.73 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 176.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.7 t -136.59 141.7 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -74.44 120.49 20.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.723 0.409 . . . . 0.0 111.15 173.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.538 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.61 -35.09 53.15 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -56.91 -55.28 45.33 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -173.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.43 0.11 9.46 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.141 1.894 . . . . 0.0 114.301 -170.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.28 -49.82 68.07 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 122.14 -0.35 . . . . 0.0 111.72 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.3 42.01 0.48 Allowed Glycine 0 CA--C 1.525 0.697 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.701 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 55.65 20.41 3.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.544 ' HB3' ' HG3' ' A' ' 86' ' ' ARG . 8.8 m-20 -70.7 -16.07 62.76 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.983 0.42 . . . . 0.0 111.85 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 82' ' ' PRO . 39.4 tp -90.21 112.0 23.36 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.887 0.375 . . . . 0.0 110.929 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HD2' ' HB2' ' A' ' 73' ' ' GLU . 3.7 tmtp? -95.61 104.27 16.18 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.862 0.363 . . . . 0.0 110.904 -178.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -69.55 94.33 0.75 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 110.022 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.562 ' HB2' ' HD2' ' A' ' 71' ' ' LYS . 11.7 tp10 -122.27 138.39 54.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.773 -169.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -83.32 176.47 9.1 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.37 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.1 t -168.42 -171.58 1.5 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.161 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 76' ' ' ARG . 39.7 mtp85 -54.07 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 111.467 -179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 144.36 -16.98 2.08 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.489 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.22 -4.17 77.9 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.902 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -95.6 129.44 42.8 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.387 -0.478 . . . . 0.0 111.936 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 87.5 mtt180 -80.29 109.46 14.79 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.978 0.418 . . . . 0.0 111.3 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -98.58 139.06 20.87 Favored Pre-proline 0 C--O 1.239 0.528 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 176.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.536 ' HB2' HD11 ' A' ' 70' ' ' LEU . 28.8 Cg_endo -63.24 97.22 0.19 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.279 1.986 . . . . 0.0 112.126 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -91.14 104.94 17.45 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.053 0.454 . . . . 0.0 111.995 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.429 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 51.3 tp -97.46 122.5 40.58 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.726 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -106.26 16.88 24.26 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.209 0.528 . . . . 0.0 111.424 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HG3' ' HB3' ' A' ' 69' ' ' ASP . 18.7 mmm180 -112.03 130.78 22.91 Favored Pre-proline 0 N--CA 1.47 0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.83 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.29 116.32 2.88 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.658 2.239 . . . . 0.0 112.709 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 50.0 tp -74.13 95.26 2.54 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 121.072 0.463 . . . . 0.0 111.622 -175.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.3 mt -59.67 122.9 15.27 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.532 HG21 ' HA ' ' A' ' 17' ' ' LYS . 83.0 t -61.58 -34.1 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.875 0.369 . . . . 0.0 111.966 -176.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -72.74 0.32 11.15 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -118.56 -1.15 11.23 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.866 0.365 . . . . 0.0 111.302 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 90' ' ' VAL . 79.8 t -74.3 139.26 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 122.183 -0.323 . . . . 0.0 111.539 -179.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 37.0 m -69.36 -59.44 2.99 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 95' ' ' ARG . 1.9 mmp_? -147.07 151.1 36.33 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 8.0 pt-20 -129.92 95.91 4.07 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.891 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.56 132.07 44.27 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.99 149.92 41.02 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.68 171.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.511 HD23 ' N ' ' A' ' 99' ' ' LEU . 1.9 pt? -150.85 146.22 26.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.094 0.473 . . . . 0.0 112.091 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -127.71 -161.49 1.09 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.81 177.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.43 HD11 ' HA2' ' A' ' 52' ' ' GLY . 98.1 mt -117.22 135.74 53.57 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -143.72 -175.55 4.62 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.665 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.83 -78.19 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 177.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -139.13 17.92 2.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.651 0.739 . . . . 0.0 110.223 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 100.2 32.47 5.53 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.093 -173.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.6 t -116.95 132.2 23.56 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 122.52 0.328 . . . . 0.0 110.665 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -79.17 77.3 4.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.865 1.71 . . . . 0.0 111.163 171.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.07 83.72 0.51 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 122.733 1.254 . . . . 0.0 111.577 -174.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 6.39 0.27 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.256 -1.338 . . . . 0.0 113.216 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.32 -25.97 4.61 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.431 -0.414 . . . . 0.0 113.644 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.5 -36.65 84.87 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.596 0.713 . . . . 0.0 110.658 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -76.7 -23.91 53.12 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.335 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.8 mt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 120.917 0.389 . . . . 0.0 111.76 -174.099 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.2 mt -125.66 150.99 47.14 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.5 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -125.02 149.8 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 120.726 0.298 . . . . 0.0 110.757 174.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.421 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.1 m-85 -130.9 141.46 50.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 35' ' ' HIS . 24.9 ttmm -134.91 127.45 30.66 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.999 173.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.4 mp -101.3 130.74 50.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -154.94 166.27 34.08 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.789 177.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 57.4 p -78.46 143.15 36.95 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 122.185 -0.322 . . . . 0.0 110.381 178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' HB3' ' A' ' 13' ' ' TRP . 79.7 ttt180 -60.97 -25.2 66.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.0 -32.15 67.64 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.03 0.443 . . . . 0.0 111.288 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -89.51 -34.82 16.26 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.244 0.545 . . . . 0.0 110.982 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.552 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 15.8 t-105 -62.02 -53.92 48.8 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.885 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.59 -30.4 67.17 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.084 0.469 . . . . 0.0 110.191 172.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.7 -48.84 79.75 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.633 177.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HA ' HG21 ' A' ' 90' ' ' VAL . 56.7 mtmt -62.16 -30.9 71.37 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.58 -36.89 63.05 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.12 0.486 . . . . 0.0 110.976 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -71.66 -25.74 62.25 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.769 177.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 -15.69 53.71 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.206 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.548 ' NH2' ' HG2' ' A' ' 87' ' ' PRO . 49.4 ttt180 -140.03 147.2 40.02 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.115 0.483 . . . . 0.0 111.461 -177.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -116.46 88.05 2.81 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.793 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.73 -15.43 62.82 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.027 0.441 . . . . 0.0 111.313 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.69 175.49 13.95 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.993 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.6 p -75.3 -176.94 3.29 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 122.634 -0.333 . . . . 0.0 110.457 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.58 62.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.222 0.534 . . . . 0.0 110.637 172.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.3 t -78.04 -52.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.583 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -58.02 -42.32 85.05 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.925 0.393 . . . . 0.0 111.245 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.65 -35.16 74.94 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.338 179.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.0 -51.72 68.49 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 110.917 175.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.37 -34.9 76.88 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.138 0.494 . . . . 0.0 111.485 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.52 -40.42 2.59 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.394 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -98.17 117.91 33.6 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.488 0.315 . . . . 0.0 110.827 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.538 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 64.5 mt -64.78 122.42 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.413 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 47.4 m-70 -83.58 124.85 31.19 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.365 175.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.698 HD13 HG13 ' A' ' 4' ' ' ILE . 98.9 mt -113.35 -64.42 1.31 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.485 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 26.5 m 73.46 154.95 0.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.207 0.527 . . . . 0.0 111.85 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.08 -176.63 5.2 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.07 -64.73 3.91 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 114.285 0.474 . . . . 0.0 114.285 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 9.7 mp0 -56.54 -47.59 79.1 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 117.082 0.441 . . . . 0.0 111.117 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 29.9 mt-30 -57.09 -35.77 69.8 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.968 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.31 -48.87 60.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.871 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.689 ' HB2' HD22 ' A' ' 109' ' ' LEU . 37.1 tt0 -65.86 -34.95 79.33 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.365 -0.209 . . . . 0.0 111.488 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.1 mt-10 -64.42 -51.08 64.99 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 175.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 m -60.2 -40.31 89.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.248 0.547 . . . . 0.0 110.463 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.638 ' HB1' ' HG2' ' A' ' 51' ' ' ARG . . . -61.43 -47.41 85.86 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.709 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' HB2' HG11 ' A' ' 106' ' ' VAL . . . -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.315 0.578 . . . . 0.0 111.973 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.36 -41.81 14.2 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.684 -176.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.8 -6.04 13.86 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -166.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -144.71 -69.65 0.29 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.638 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.4 mmt180 -57.99 93.0 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.719 0.771 . . . . 0.0 112.918 -173.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.41 26.93 0.05 OUTLIER Glycine 0 CA--C 1.525 0.685 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.01 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.746 HE21 HD21 ' A' ' 56' ' ' LEU . 11.5 pt20 -165.8 176.47 7.92 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.747 0.308 . . . . 0.0 111.627 -174.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.81 166.98 14.2 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' SER . 87.6 m-20 65.08 19.48 11.82 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 175.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.746 HD21 HE21 ' A' ' 53' ' ' GLN . 65.1 mt -84.81 93.47 8.49 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.97 139.62 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.179 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.423 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 63.3 tp -107.4 99.92 9.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 74.2 mt -75.96 105.36 6.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.983 0.42 . . . . 0.0 111.027 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.21 102.6 12.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.767 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -105.2 139.82 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.802 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 94' ' ' THR . 4.2 mm-40 -79.29 115.33 18.88 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.554 0.216 . . . . 0.0 110.741 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.43 21.36 1.19 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.326 0.584 . . . . 0.0 111.192 177.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.59 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 32.6 tt0 -71.17 -41.1 10.21 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -176.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 11.7 Cg_endo -55.71 -67.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 121.742 1.628 . . . . 0.0 111.865 173.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.84 58.56 5.33 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 121.122 0.487 . . . . 0.0 112.278 171.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -98.43 -109.41 2.87 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.364 -0.446 . . . . 0.0 112.448 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 14.58 27.21 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.618 0.723 . . . . 0.0 110.558 173.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.568 ' HA ' HH11 ' A' ' 86' ' ' ARG . 0.8 OUTLIER -89.88 -69.54 0.71 Allowed 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.165 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.505 HD13 HD12 ' A' ' 36' ' ' LEU . 58.7 tp -100.29 134.54 43.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -176.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -124.39 128.34 48.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.756 0.312 . . . . 0.0 111.639 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -74.0 106.59 5.76 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.09 136.6 51.41 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -132.72 102.98 5.89 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -176.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 78.9 p -54.59 -48.28 72.33 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.154 0.502 . . . . 0.0 111.577 175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -80.38 5.57 14.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.402 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.72 -67.13 3.6 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.158 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.51 144.71 29.56 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.899 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 66.14 95.93 0.06 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.168 0.509 . . . . 0.0 111.19 -175.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.82 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 68.7 mtp180 -87.31 117.53 26.14 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.815 -172.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.409 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 65.4 m-85 -90.07 113.08 55.89 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 81' ' ' PHE . 19.5 Cg_endo -60.52 115.05 2.41 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.959 1.773 . . . . 0.0 112.052 174.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -115.63 136.88 52.62 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.933 0.397 . . . . 0.0 111.453 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.538 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 38.1 tp -98.44 107.13 19.52 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.099 0.476 . . . . 0.0 110.511 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -83.26 30.77 0.46 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -175.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.568 HH11 ' HA ' ' A' ' 69' ' ' ASP . 4.2 ptm180 -159.14 143.93 11.51 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 122.328 -0.232 . . . . 0.0 111.274 -177.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.548 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 13.9 Cg_endo -57.38 119.14 6.21 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.603 2.202 . . . . 0.0 112.945 177.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 tp -72.49 148.6 44.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.779 -174.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.495 HD23 ' HG3' ' A' ' 21' ' ' ARG . 42.9 mt -96.67 146.81 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 122.102 -0.374 . . . . 0.0 110.529 177.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.434 HG21 ' HA ' ' A' ' 17' ' ' LYS . 78.0 t -64.04 -39.74 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 O-C-N 122.05 -0.406 . . . . 0.0 111.427 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 t -72.17 -7.59 50.04 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.087 0.47 . . . . 0.0 111.1 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 26.6 tt0 -97.9 -7.3 30.51 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.408 0.623 . . . . 0.0 110.518 177.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.4 t -85.82 110.74 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.847 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.684 HG22 ' HD3' ' A' ' 95' ' ' ARG . 4.0 m -64.59 -67.91 0.4 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' A' ' 94' ' ' THR . 1.3 mpp_? -115.18 130.9 57.04 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 14.3 pt-20 -103.07 87.8 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.579 0.704 . . . . 0.0 109.641 169.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -85.23 140.2 31.06 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -171.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -83.58 157.37 22.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.134 0.492 . . . . 0.0 111.361 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.602 HD23 ' H ' ' A' ' 99' ' ' LEU . 2.7 pt? -85.64 119.29 25.81 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.498 0.666 . . . . 0.0 112.758 -176.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -114.18 94.36 4.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 166.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.587 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 65.5 mt -102.6 158.23 16.38 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -159.71 172.18 18.2 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.1 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.5 -82.91 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -117.59 8.67 12.93 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.113 0.482 . . . . 0.0 111.121 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 71.57 29.7 67.49 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.012 -174.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.847 ' H ' ' HD3' ' A' ' 107' ' ' PRO . 24.1 t -136.4 -22.1 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.453 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.847 ' HD3' ' H ' ' A' ' 106' ' ' VAL . 21.1 Cg_endo -90.25 50.2 1.03 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.697 1.598 . . . . 0.0 113.94 -163.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.649 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.0 OUTLIER -126.14 26.03 6.58 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -171.759 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.689 HD22 ' HB2' ' A' ' 43' ' ' GLN . 1.5 mp -100.65 -12.25 19.33 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.07 -9.17 46.55 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.389 177.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.23 -30.21 27.86 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.259 0.552 . . . . 0.0 111.198 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -100.56 -44.15 5.95 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.262 -172.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 53.5 mt . . . . . 0 N--CA 1.467 0.383 0 CA-C-O 121.378 0.609 . . . . 0.0 111.051 -178.871 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.909 0.385 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.63 144.08 29.13 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.069 0.461 . . . . 0.0 111.701 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.558 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 5.2 mt -107.14 146.0 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.405 178.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 34.3 m-85 -134.97 138.71 44.28 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -176.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 67.2 tttt -151.18 122.65 7.89 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.982 0.42 . . . . 0.0 111.372 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.533 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -94.29 135.78 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.126 -178.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.467 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -150.23 167.45 26.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.89 0.376 . . . . 0.0 111.093 178.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 t -71.1 149.34 46.57 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.728 0.299 . . . . 0.0 111.301 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.05 -38.91 71.25 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.875 0.369 . . . . 0.0 110.918 177.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.3 77.54 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.025 0.44 . . . . 0.0 111.699 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -69.7 -40.28 76.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.149 0.5 . . . . 0.0 111.164 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.495 ' NE1' ' HE3' ' A' ' 17' ' ' LYS . 22.1 t-105 -73.23 -46.13 51.97 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.891 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.16 -41.21 92.31 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.827 0.346 . . . . 0.0 110.965 176.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.36 82.03 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.165 0.507 . . . . 0.0 110.846 174.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 13' ' ' TRP . . . -59.01 -47.55 84.78 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.147 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HE3' ' NE1' ' A' ' 13' ' ' TRP . 96.2 mttt -60.06 -37.81 80.96 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.306 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.87 90.7 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.848 0.356 . . . . 0.0 111.807 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.47 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 28.6 pt20 -94.92 -3.02 49.41 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.804 0.335 . . . . 0.0 111.812 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.67 6.96 60.38 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.505 -0.379 . . . . 0.0 113.293 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 68.6 mtt180 -143.8 157.44 44.37 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 122.505 -0.409 . . . . 0.0 111.408 -175.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 23' ' ' GLU . 46.7 t80 -134.83 178.84 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 170.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 87' ' ' PRO . 67.3 mm-40 92.45 156.12 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.246 1.019 . . . . 0.0 113.703 172.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.04 42.52 24.38 Favored Glycine 0 CA--C 1.526 0.751 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.548 -170.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.1 p -81.56 -176.63 6.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.713 0.292 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.55 -51.01 61.73 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.701 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 36.2 t -69.88 -51.17 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -54.72 -44.17 73.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.864 0.364 . . . . 0.0 111.669 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.13 -35.23 69.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.04 90.02 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.901 0.381 . . . . 0.0 111.408 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -69.84 -39.3 76.51 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.983 0.42 . . . . 0.0 111.07 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 129.41 -25.07 4.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.123 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -159.04 161.44 36.55 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.685 0.394 . . . . 0.0 110.663 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 23' ' ' GLU . 66.0 mt -61.82 140.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.143 0.497 . . . . 0.0 112.312 -173.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -139.32 105.97 5.36 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.053 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 3.8 mp -98.21 -175.41 3.11 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.515 175.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.5 m -131.97 155.37 48.09 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.22 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.31 173.23 12.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.657 174.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.92 -57.41 11.06 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.667 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.05 -42.79 99.8 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.122 0.486 . . . . 0.0 111.505 178.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -74.29 -15.1 60.98 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.914 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -70.85 -49.77 42.52 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.093 0.473 . . . . 0.0 110.686 176.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 109' ' ' LEU . 6.4 tp-100 -61.5 -36.99 82.06 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.089 0.471 . . . . 0.0 110.639 174.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.1 -47.18 85.78 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.143 0.497 . . . . 0.0 110.873 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 92.7 m -61.55 -31.23 71.25 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.059 0.457 . . . . 0.0 110.811 175.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.59 -58.43 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.812 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.61 -30.56 55.08 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.982 0.42 . . . . 0.0 112.12 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -84.69 -49.24 8.68 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -116.55 -35.4 4.25 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 98.5 m-85 -114.06 59.08 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.612 0.72 . . . . 0.0 110.728 -176.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -72.0 -4.66 29.89 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.25 -0.886 . . . . 0.0 112.797 -174.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.57 -96.76 0.1 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.56 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.0 mt-30 59.79 -164.08 0.22 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.613 0.365 . . . . 0.0 111.651 -176.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.63 120.49 30.9 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.858 -0.526 . . . . 0.0 111.7 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 57.5 83.12 0.11 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.01 0.524 . . . . 0.0 112.185 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 53' ' ' GLN . 79.6 mt -99.09 123.55 43.46 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.576 177.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.423 ' O ' HD23 ' A' ' 8' ' ' LEU . 48.4 t -87.73 127.62 40.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HB2' HD11 ' A' ' 99' ' ' LEU . 67.4 tp -99.6 99.77 10.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.274 174.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 89.0 mt -75.61 107.72 7.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.751 177.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.558 ' HA ' ' O ' ' A' ' 4' ' ' ILE . . . -117.29 114.05 23.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.601 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 94' ' ' THR . 43.5 t -127.0 142.53 43.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.487 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 0.7 OUTLIER -69.86 133.81 47.78 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.456 175.261 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.6 30.54 0.24 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -174.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.32 -41.59 2.41 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 122.039 -0.413 . . . . 0.0 111.772 174.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' A' ' 62' ' ' GLU . 18.2 Cg_exo -70.27 39.21 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.591 2.194 . . . . 0.0 112.405 168.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 70' ' ' LEU . 48.8 tp -61.68 -41.93 98.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.565 0.746 . . . . 0.0 112.394 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 60.71 -114.87 7.02 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.171 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.9 10.61 0.47 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.365 0.602 . . . . 0.0 110.966 175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -102.16 -26.18 13.45 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.494 ' HB3' HD12 ' A' ' 66' ' ' LEU . 38.6 tp -70.5 96.77 1.21 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.438 0.637 . . . . 0.0 110.291 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.585 ' HG2' ' HB2' ' A' ' 73' ' ' GLU . 39.1 ttmt -103.26 102.29 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.68 -175.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 45.7 m95 -70.42 98.14 1.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 71' ' ' LYS . 9.7 tp10 -137.9 159.9 40.76 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.716 -169.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.37 179.15 4.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.071 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 88.5 p -134.6 -68.76 0.53 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.036 0.446 . . . . 0.0 111.346 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -106.42 -66.8 0.98 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.77 -107.2 0.63 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.295 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.61 -163.45 10.21 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.928 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 69.7 143.87 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.426 0.631 . . . . 0.0 112.43 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.42 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 79.8 mtt180 -100.27 117.79 35.21 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.056 0.455 . . . . 0.0 111.747 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -97.96 129.76 30.32 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.447 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.487 ' HB2' HD11 ' A' ' 70' ' ' LEU . 37.8 Cg_endo -66.83 103.93 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.117 1.878 . . . . 0.0 112.533 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' LEU . 74.6 m80 -96.51 154.29 17.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.078 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.0 mt -129.74 145.93 51.52 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 112.358 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -114.12 10.19 17.35 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.836 171.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.421 ' HA ' ' HE ' ' A' ' 86' ' ' ARG . 1.4 mmp_? -118.43 133.97 23.48 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.238 177.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 23' ' ' GLU . 14.2 Cg_exo -68.51 136.81 37.61 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 121.601 1.534 . . . . 0.0 111.583 173.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.94 101.48 6.87 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.292 0.568 . . . . 0.0 111.707 -171.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.96 120.13 11.39 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.309 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.409 HG11 ' HG2' ' A' ' 17' ' ' LYS . 80.2 t -53.38 -36.14 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.067 0.46 . . . . 0.0 111.565 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.3 t -60.07 -30.43 69.21 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -79.76 -20.23 46.8 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.832 0.349 . . . . 0.0 111.49 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.7 124.94 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 120.683 0.278 . . . . 0.0 111.668 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.469 HG23 HG13 ' A' ' 61' ' ' VAL . 82.6 p -77.18 -57.72 3.68 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 60' ' ' ALA . 6.7 ptp85 -131.54 145.41 51.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.144 0.497 . . . . 0.0 112.113 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.416 ' CD ' ' HE1' ' A' ' 13' ' ' TRP . 8.1 pt-20 -122.36 97.73 5.6 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.145 0.498 . . . . 0.0 111.037 176.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -82.75 118.49 23.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 111.648 -176.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -84.32 105.86 15.48 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.094 0.473 . . . . 0.0 110.486 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 58' ' ' LEU . 73.2 mt -82.85 103.35 12.26 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.188 0.518 . . . . 0.0 112.386 -173.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -91.6 142.01 28.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.194 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.61 127.21 32.58 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -176.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -134.73 167.79 20.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.631 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.63 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 173.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -100.49 3.91 43.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.643 0.259 . . . . 0.0 111.664 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.51 22.55 72.56 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.136 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.9 t -123.14 136.34 26.88 Favored Pre-proline 0 N--CA 1.471 0.588 0 C-N-CA 123.248 0.619 . . . . 0.0 110.256 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 53.1 Cg_exo -54.35 117.68 4.2 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.676 2.251 . . . . 0.0 113.761 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -75.39 98.24 3.83 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.8 mp -100.43 -40.63 7.38 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.988 -0.445 . . . . 0.0 111.76 173.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.03 -42.9 31.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.617 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -89.56 -29.34 18.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -66.44 -33.3 75.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 59.8 mt . . . . . 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.566 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.78 0.324 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.8 mt -111.59 130.0 55.89 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.627 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.501 HG13 HD22 ' A' ' 36' ' ' LEU . 16.8 pt -114.32 132.22 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-O 121.335 0.588 . . . . 0.0 110.935 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.797 ' HB3' HD21 ' A' ' 58' ' ' LEU . 32.3 m-85 -107.6 135.2 49.45 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.015 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.597 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 50.0 tttm -120.8 124.23 44.55 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 122.355 -0.215 . . . . 0.0 111.207 175.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.2 mp -93.23 136.91 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.505 HD21 ' HG ' ' A' ' 59' ' ' LEU . 2.2 pt? -153.87 174.01 15.15 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.023 0.44 . . . . 0.0 111.622 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -85.87 150.65 24.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.971 0.415 . . . . 0.0 111.41 175.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -34.14 70.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.01 0.433 . . . . 0.0 110.248 177.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.89 -39.55 85.71 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.444 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.48 ' OE1' ' HB2' ' A' ' 25' ' ' SER . 52.7 mt-10 -62.45 -53.32 56.54 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.341 0.591 . . . . 0.0 110.908 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.411 ' CH2' HG13 ' A' ' 90' ' ' VAL . 47.0 t-105 -60.91 -60.36 3.91 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.612 -174.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.548 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -61.18 -31.59 71.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.357 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -65.4 -59.16 4.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.011 0.434 . . . . 0.0 110.67 174.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.7 69.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.993 0.425 . . . . 0.0 111.808 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HA ' HG21 ' A' ' 90' ' ' VAL . 37.2 ttpt -71.21 -26.69 63.05 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.931 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.56 -30.62 52.73 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.819 172.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 7.7 mm-40 -78.97 -29.63 44.01 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.934 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.52 -2.48 65.01 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.157 -0.474 . . . . 0.0 113.214 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 10.3 ptm180 -148.21 125.24 11.36 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 122.404 -0.468 . . . . 0.0 111.925 -174.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.597 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 53.6 t80 -93.84 116.96 29.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.04 0.448 . . . . 0.0 110.505 176.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -109.96 9.96 24.32 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -174.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.95 175.6 20.93 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.844 -0.693 . . . . 0.0 114.551 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.48 ' HB2' ' OE1' ' A' ' 12' ' ' GLU . 38.8 t -128.52 -175.81 3.63 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.006 0.522 . . . . 0.0 110.889 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.46 -33.02 63.26 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.405 HG12 ' CE1' ' A' ' 35' ' ' HIS . 41.3 t -70.76 -45.91 71.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.418 0.627 . . . . 0.0 111.051 177.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.515 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 14.7 m-20 -62.6 -38.6 90.8 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.898 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.55 -21.92 60.23 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.648 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.5 -39.98 85.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.053 0.454 . . . . 0.0 110.877 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.46 -59.4 2.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.368 0.604 . . . . 0.0 110.734 171.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 154.71 -49.32 0.49 Allowed Glycine 0 CA--C 1.525 0.68 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.737 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -128.93 169.43 14.65 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.607 0.363 . . . . 0.0 110.852 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.0 mt -54.59 134.06 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.824 0.345 . . . . 0.0 111.274 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.515 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 25.5 p80 -143.3 123.61 13.82 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.212 0.53 . . . . 0.0 111.761 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 6' ' ' LYS . 5.0 mp -96.58 -163.06 1.01 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.676 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' HB2' ' A' ' 41' ' ' GLN . 81.9 p -137.76 150.09 46.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.837 0.351 . . . . 0.0 111.327 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -98.91 109.53 22.27 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -176.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.78 -103.78 0.26 Allowed Glycine 0 CA--C 1.53 1.002 0 N-CA-C 114.579 0.592 . . . . 0.0 114.579 173.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.06 -42.01 84.55 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.788 0.328 . . . . 0.0 111.642 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 53.0 mt-30 -53.21 -28.71 28.24 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.017 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.48 -56.56 13.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.486 178.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -61.43 -43.04 99.57 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.373 178.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 18.8 mm-40 -55.55 -57.0 13.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.943 177.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 84.6 m -57.3 -38.46 74.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.942 0.401 . . . . 0.0 111.363 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.15 83.38 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.966 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.86 -24.65 28.47 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 67.1 mttm -88.87 -59.01 2.34 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -97.18 -33.87 11.33 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -170.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -98.75 64.47 1.48 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.506 0.669 . . . . 0.0 110.853 -173.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 51' ' ' ARG . 4.5 mmp_? -109.36 139.14 44.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.804 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.24 39.85 93.06 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 114.959 0.744 . . . . 0.0 114.959 174.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.558 ' HB2' HD21 ' A' ' 56' ' ' LEU . 45.0 mt-30 -116.14 142.74 46.42 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 117.351 0.576 . . . . 0.0 111.116 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.49 127.63 32.44 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 58.95 84.1 0.11 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.429 177.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 53' ' ' GLN . 85.6 mt -101.65 134.96 43.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.274 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.8 t -113.09 152.96 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 110.928 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 5' ' ' TYR . 3.2 tt -129.2 114.88 16.85 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.008 0.433 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' HD21 ' A' ' 8' ' ' LEU . 86.5 mt -90.83 107.22 19.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.996 0.426 . . . . 0.0 110.873 177.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.523 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -95.87 107.37 19.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.505 177.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.23 143.91 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.014 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -72.27 127.97 34.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 122.096 -0.377 . . . . 0.0 110.604 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.15 -47.91 71.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.037 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 63.38 161.86 0.12 Allowed Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.79 -62.15 0.23 Allowed 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.485 2.123 . . . . 0.0 112.963 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 19.0 66.03 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -44.46 130.95 7.38 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 115.067 -0.969 . . . . 0.0 114.918 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 78.66 -24.67 0.21 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -69.0 -42.29 76.67 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.648 -0.657 . . . . 0.0 111.053 172.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.99 143.3 32.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 111.01 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -153.61 132.08 12.11 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.809 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 80' ' ' ARG . 93.0 m95 -77.84 64.05 3.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.701 0.762 . . . . 0.0 110.55 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -80.03 132.56 36.02 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.644 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -147.23 165.8 28.96 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.122 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 55.7 m -122.42 -178.08 3.8 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.779 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 75.18 -47.37 0.61 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 165.43 -34.42 0.25 Allowed Glycine 0 CA--C 1.524 0.624 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.689 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.22 -149.08 5.35 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.294 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 64.03 -175.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.124 0.488 . . . . 0.0 111.951 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.414 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 38.4 ptt180 -160.07 135.74 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.783 0.325 . . . . 0.0 111.369 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.425 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 92.3 m-85 -131.21 123.21 19.57 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 173.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.64 95.06 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 121.942 1.761 . . . . 0.0 112.637 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 81' ' ' PHE . 12.0 m170 -88.36 123.12 32.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.19 177.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -101.35 112.56 25.12 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.273 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -82.15 8.25 11.41 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -174.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -111.36 148.64 39.21 Favored Pre-proline 0 N--CA 1.473 0.689 0 O-C-N 122.034 -0.416 . . . . 0.0 110.904 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.66 109.47 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.022 1.815 . . . . 0.0 110.975 171.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.43 104.69 1.29 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.303 0.573 . . . . 0.0 110.825 -171.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.21 137.27 50.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.107 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.599 HG21 ' HA ' ' A' ' 17' ' ' LYS . 68.0 t -57.68 -34.73 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.8 m -69.46 -9.24 52.83 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.835 -0.621 . . . . 0.0 112.183 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -105.91 -6.99 18.44 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.926 0.393 . . . . 0.0 111.826 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 59' ' ' LEU . 58.7 t -69.74 110.46 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 122.024 -0.422 . . . . 0.0 111.233 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 85.1 m -48.81 -58.52 4.68 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -147.78 138.42 23.18 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.358 0.599 . . . . 0.0 112.104 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.89 118.88 35.46 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.442 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.97 108.45 12.95 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 122.025 -0.422 . . . . 0.0 111.969 -178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.0 126.59 31.23 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.234 0.54 . . . . 0.0 110.866 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -83.87 111.1 18.92 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -74.85 -11.72 60.21 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 177.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.3 mt 65.64 -167.43 0.21 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.693 0.397 . . . . 0.0 111.261 -176.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -149.05 -172.85 4.22 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 122.289 -0.257 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -28.49 65.42 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.68 -3.63 58.74 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.148 0.499 . . . . 0.0 110.649 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.11 -6.83 61.79 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 116.057 -0.519 . . . . 0.0 112.989 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.98 133.34 39.41 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.669 -0.312 . . . . 0.0 111.344 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.96 118.63 5.66 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.158 1.905 . . . . 0.0 112.354 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -66.3 97.99 0.44 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.34 0.59 . . . . 0.0 112.186 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.1 mp -100.17 -15.78 18.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.948 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -53.84 -33.39 49.61 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.759 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -68.54 -37.04 79.62 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 122.799 0.44 . . . . 0.0 111.652 174.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -85.45 -30.17 23.73 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -173.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 40.0 mt . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -176.272 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 63' ' ' ALA . 14.0 m . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 62' ' ' GLU . 0.4 OUTLIER -128.46 132.0 48.39 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.931 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.605 HD12 HD22 ' A' ' 36' ' ' LEU . 14.1 pt -114.16 145.76 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.542 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.9 m-85 -123.81 146.5 48.31 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.726 -176.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.54 ' HD3' ' HG ' ' A' ' 36' ' ' LEU . 6.4 ttpm? -156.35 125.28 5.99 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.252 -0.28 . . . . 0.0 111.433 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 55.6 mt -94.91 135.94 27.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 120.797 0.332 . . . . 0.0 111.808 -178.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -143.79 172.03 13.4 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.624 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.6 m -76.0 142.57 41.85 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.852 0.358 . . . . 0.0 111.587 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -55.94 -44.17 78.12 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.56 80.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.15 0.5 . . . . 0.0 112.127 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -69.42 -43.25 73.76 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.039 0.447 . . . . 0.0 110.95 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.6 t-105 -66.54 -34.75 78.6 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.628 177.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 24.4 t70 -60.04 -52.08 66.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.338 0.589 . . . . 0.0 110.432 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -55.32 -39.99 70.62 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.105 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 22' ' ' PHE . . . -59.82 -45.77 91.31 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.397 175.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.55 ' HA ' HG21 ' A' ' 90' ' ' VAL . 10.5 mtmp? -61.0 -36.0 78.33 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.859 0.361 . . . . 0.0 111.054 176.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -42.41 98.99 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.136 0.494 . . . . 0.0 111.129 174.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 77.0 mm-40 -70.74 -26.61 63.45 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.223 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.5 -1.51 61.1 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.406 -0.426 . . . . 0.0 112.405 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -150.77 134.57 16.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.099 0.56 . . . . 0.0 110.346 -173.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' ' HB1' ' A' ' 16' ' ' ALA . 90.1 t80 -134.9 130.25 35.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.85 0.357 . . . . 0.0 111.55 -176.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.677 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 1.7 pm0 -100.69 -75.19 0.59 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.294 175.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.677 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . -157.88 -123.62 0.75 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.717 -176.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.44 ' H ' ' HB3' ' A' ' 28' ' ' ASP . 23.2 t -175.69 -164.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.583 -0.363 . . . . 0.0 111.1 -173.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.89 -63.29 1.23 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' A' ' 30' ' ' ALA . 7.6 p -55.8 -40.33 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-O 121.119 0.485 . . . . 0.0 111.509 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -57.04 -54.68 44.02 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.426 177.274 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.09 -13.4 61.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' VAL . . . -66.04 -54.66 23.09 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.753 0.311 . . . . 0.0 110.614 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.42 -42.19 25.99 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.655 0.264 . . . . 0.0 111.229 174.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.42 13.42 7.51 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 170.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -148.41 139.27 23.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.852 0.826 . . . . 0.0 112.292 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mt -65.02 87.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.481 0.658 . . . . 0.0 111.157 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -93.29 112.07 23.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.605 HD22 HD12 ' A' ' 4' ' ' ILE . 4.8 mp -94.71 -160.65 0.79 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.667 176.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.5 p -142.88 153.03 42.73 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.867 0.365 . . . . 0.0 111.0 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.22 178.82 5.49 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.851 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.65 -67.56 2.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.035 -0.603 . . . . 0.0 113.653 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 3.3 mp0 -56.08 -42.77 77.22 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 122.642 -0.328 . . . . 0.0 111.12 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.503 ' NE2' ' HB1' ' A' ' 79' ' ' ALA . 82.8 mt-30 -56.56 -44.06 80.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.834 0.35 . . . . 0.0 111.428 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.41 95.96 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.995 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.602 ' HB2' HD11 ' A' ' 109' ' ' LEU . 34.2 tt0 -64.1 -37.98 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.605 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.8 mt-10 -62.51 -51.77 66.12 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.877 0.37 . . . . 0.0 110.956 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 63.9 m -60.84 -35.27 76.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.027 0.442 . . . . 0.0 110.886 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.526 ' HB1' ' HG3' ' A' ' 107' ' ' PRO . . . -67.85 -48.82 65.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.743 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.7 -14.82 55.68 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.073 0.463 . . . . 0.0 111.606 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -98.98 -63.05 1.16 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.412 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -84.9 -49.06 8.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.165 0.507 . . . . 0.0 112.136 -176.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -97.42 56.1 1.31 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.961 0.41 . . . . 0.0 111.469 -173.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.85 -33.95 38.52 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 170.77 44.99 0.03 OUTLIER Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.11 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.553 ' HB2' HD21 ' A' ' 56' ' ' LEU . 85.2 mt-30 -79.06 133.47 36.79 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.896 0.379 . . . . 0.0 111.713 -174.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.93 61.41 5.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.131 0.491 . . . . 0.0 112.154 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -171.79 29.9 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.439 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 53' ' ' GLN . 22.3 mt -106.56 141.77 37.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 88.1 t -125.88 117.55 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.548 174.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.542 HD11 ' HB3' ' A' ' 5' ' ' TYR . 66.0 tp -93.14 100.08 12.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.707 178.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.6 mt -75.81 109.35 9.35 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.719 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -99.57 112.04 24.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 175.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.1 t -120.72 138.33 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 121.008 0.433 . . . . 0.0 112.148 -175.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.491 ' HA ' HD22 ' A' ' 3' ' ' LEU . 9.0 pt-20 -69.23 108.4 3.63 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.722 0.772 . . . . 0.0 110.281 175.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.521 ' HB3' HG22 ' A' ' 2' ' ' THR . . . -85.69 1.56 48.9 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -169.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.55 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 39.8 mt-10 -80.76 -49.94 1.06 Allowed Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 76.0 Cg_exo -52.5 -48.63 20.9 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 122.336 2.024 . . . . 0.0 113.06 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 pp -92.79 10.79 29.4 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -57.78 -28.29 60.16 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 114.652 0.621 . . . . 0.0 114.652 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -66.31 -26.44 67.31 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.361 0.581 . . . . 0.0 111.533 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.37 11.84 30.48 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.259 177.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 82' ' ' PRO . 42.0 tp -113.69 102.97 10.76 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.36 107.32 19.07 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 59.9 m95 -69.39 84.57 0.4 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.793 0.806 . . . . 0.0 109.489 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -119.85 120.49 36.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.287 -167.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.12 89.26 1.14 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.02 0.438 . . . . 0.0 111.409 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.5 p -75.2 78.89 2.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.685 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 63.37 178.52 0.16 Allowed 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.498 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.65 -66.93 2.66 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.97 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.58 -19.84 2.03 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.794 -178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.503 ' HB1' ' NE2' ' A' ' 41' ' ' GLN . . . -83.84 129.18 34.94 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.209 0.528 . . . . 0.0 112.006 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.3 mtp85 -70.85 104.35 2.89 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.478 176.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -94.4 123.27 59.09 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 120.802 0.334 . . . . 0.0 111.419 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 70' ' ' LEU . 40.9 Cg_endo -67.42 109.15 1.74 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.531 2.154 . . . . 0.0 112.385 177.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -100.02 106.51 18.28 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.476 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.8 tp -93.5 138.67 31.56 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.97 0.414 . . . . 0.0 111.123 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.93 29.81 7.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.476 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 28.7 mmt180 -138.11 141.15 31.15 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 122.538 0.335 . . . . 0.0 111.711 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 23.2 Cg_exo -64.97 120.36 7.58 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.769 2.312 . . . . 0.0 112.298 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 62.7 tp -81.23 110.86 17.1 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.063 0.459 . . . . 0.0 111.527 -177.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.28 136.26 53.22 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.215 -0.303 . . . . 0.0 110.448 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 17' ' ' LYS . 91.4 t -58.37 -41.17 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.247 0.546 . . . . 0.0 110.935 178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.2 t -70.94 -10.08 59.03 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.828 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -95.73 -15.0 22.91 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.975 0.417 . . . . 0.0 111.333 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.25 145.0 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.968 0.413 . . . . 0.0 111.285 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 31.1 m -80.26 -50.77 9.76 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.909 0.385 . . . . 0.0 111.298 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.418 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 9.7 tpp180 -150.14 143.95 25.38 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.271 0.558 . . . . 0.0 111.788 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 9.1 pt-20 -116.41 98.76 6.75 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.081 173.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -89.09 87.36 7.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.165 0.507 . . . . 0.0 111.72 -176.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -67.95 103.93 1.6 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.333 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.3 tp 60.11 101.64 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.026 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 13.8 t70 -119.51 89.86 3.21 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.043 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.49 164.04 22.79 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 0.0 112.094 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.895 ' HB2' ' HB2' ' A' ' 108' ' ' GLN . 5.9 t70 -111.74 -169.41 1.46 Allowed 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.019 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.14 -25.75 61.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -89.41 0.93 56.49 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 75.96 5.56 80.36 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.69 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.4 t -89.45 135.8 30.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 122.32 0.248 . . . . 0.0 110.509 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.526 ' HG3' ' HB1' ' A' ' 46' ' ' ALA . 20.4 Cg_endo -59.44 95.95 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.289 1.993 . . . . 0.0 111.586 175.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.895 ' HB2' ' HB2' ' A' ' 102' ' ' ASP . 2.6 tp-100 -83.83 44.53 1.0 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.732 0.777 . . . . 0.0 110.699 -174.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.602 HD11 ' HB2' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.12 5.82 0.32 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.145 -0.934 . . . . 0.0 113.186 -176.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.95 -34.95 31.46 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.688 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -65.08 -27.63 68.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.034 0.445 . . . . 0.0 111.281 174.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -80.26 -24.2 40.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 120.973 0.416 . . . . 0.0 110.745 173.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.5 mt . . . . . 0 N--CA 1.47 0.572 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.77 -176.195 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.37 99.43 4.13 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.948 0.404 . . . . 0.0 111.714 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.588 HD12 HD13 ' A' ' 36' ' ' LEU . 15.4 pt -104.86 142.66 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 110.69 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -125.19 152.22 44.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.225 0.536 . . . . 0.0 112.098 -172.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HZ1' ' CG ' ' A' ' 28' ' ' ASP . 62.6 tttp -147.54 106.66 3.86 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.613 175.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -91.51 137.62 21.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.229 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.18 172.62 17.29 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.001 0.429 . . . . 0.0 111.268 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 94.4 p -76.24 146.4 39.05 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.054 0.454 . . . . 0.0 111.43 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -41.92 62.07 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.555 -179.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.46 -51.07 71.46 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.81 -29.48 69.96 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.028 0.442 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -70.23 -44.69 68.04 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.143 175.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -33.38 72.93 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.221 -0.3 . . . . 0.0 111.114 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.53 -40.96 88.9 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.853 175.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.58 79.52 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.379 174.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -58.6 -37.19 75.29 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.066 0.46 . . . . 0.0 111.211 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.73 -52.77 61.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.687 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 11.5 pt20 -77.24 -10.47 59.44 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 81.41 -45.14 3.18 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-O 121.354 0.419 . . . . 0.0 112.678 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.41 ' HG2' HD23 ' A' ' 89' ' ' LEU . 48.0 mtm180 -94.17 -173.93 3.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.451 0.643 . . . . 0.0 111.208 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -141.23 94.68 2.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.581 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -72.42 -20.91 61.34 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.91 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.85 152.89 6.67 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.043 -0.526 . . . . 0.0 113.073 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 86.2 p -91.12 -171.66 3.05 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.97 -53.57 15.63 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 64.0 t -59.88 -53.75 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.517 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 12.9 m-20 -57.96 -47.5 82.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.237 0.541 . . . . 0.0 111.713 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.89 -16.81 62.71 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.697 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -55.66 7.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -79.03 -51.59 9.38 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.44 -34.23 0.59 Allowed Glycine 0 CA--C 1.529 0.926 0 C-N-CA 120.298 -0.953 . . . . 0.0 114.561 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -131.1 157.08 44.07 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 117.455 0.627 . . . . 0.0 111.94 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.759 HD12 HD13 ' A' ' 88' ' ' LEU . 66.9 mt -70.58 114.83 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.577 0.703 . . . . 0.0 111.989 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -81.43 124.62 29.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.845 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 HD12 ' A' ' 4' ' ' ILE . 81.6 mt -109.82 111.31 22.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.702 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -77.85 105.85 9.31 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.288 0.566 . . . . 0.0 111.917 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.91 101.92 3.94 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.95 -95.99 0.01 OUTLIER Glycine 0 CA--C 1.532 1.098 0 N-CA-C 114.706 0.643 . . . . 0.0 114.706 173.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.39 -43.48 61.93 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.287 0.565 . . . . 0.0 111.366 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.13 -37.08 85.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.173 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -61.08 -44.66 97.03 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.628 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -67.0 -36.9 83.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.26 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.38 -56.7 17.4 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.912 0.386 . . . . 0.0 110.805 175.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.9 m -57.59 -38.56 75.07 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 111.377 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.87 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -68.34 -39.14 82.02 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.68 -19.25 60.34 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 111.712 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -93.2 -57.88 2.48 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.102 0.477 . . . . 0.0 111.565 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.71 -55.72 3.84 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -92.29 17.75 9.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -171.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -64.97 113.76 4.09 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.934 0.397 . . . . 0.0 111.428 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.77 25.96 73.96 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 114.237 0.455 . . . . 0.0 114.237 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -99.97 163.46 12.43 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 117.352 0.576 . . . . 0.0 111.451 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -109.21 174.18 5.98 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.862 -179.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 62.52 26.01 15.47 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.841 0.456 . . . . 0.0 112.029 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -88.47 111.48 21.86 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.75 135.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 121.006 0.431 . . . . 0.0 110.455 174.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.411 ' O ' HD23 ' A' ' 58' ' ' LEU . 7.4 tt -102.25 106.23 17.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.037 0.446 . . . . 0.0 110.465 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.496 HD22 HG21 ' A' ' 93' ' ' VAL . 61.3 mt -84.97 107.29 17.03 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.691 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.514 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -102.96 117.86 35.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.743 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 4' ' ' ILE . 53.4 t -117.57 116.24 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.518 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.62 95.77 0.89 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -42.53 -65.65 0.45 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -170.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 64.75 158.35 0.12 Allowed Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 120.789 0.328 . . . . 0.0 110.976 -173.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 57.36 3.4 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.234 1.956 . . . . 0.0 112.809 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.603 HD12 ' N ' ' A' ' 67' ' ' GLY . 1.6 pp -67.32 -28.88 68.35 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.603 ' N ' HD12 ' A' ' 66' ' ' LEU . . . 176.35 154.08 11.31 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.741 -179.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.51 -23.89 67.58 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.118 0.485 . . . . 0.0 111.438 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -65.71 -9.54 28.76 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.107 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.577 ' HB2' HD13 ' A' ' 84' ' ' LEU . 57.8 tp -98.54 100.89 12.17 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 168.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -116.36 133.47 55.99 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.094 0.473 . . . . 0.0 112.067 -176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -73.97 91.51 2.03 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.33 0.586 . . . . 0.0 110.259 172.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.31 143.08 35.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.173 -174.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -115.2 91.85 3.74 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 174.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.3 m -69.7 168.39 15.03 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.859 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.0 tpp85 -58.19 95.64 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.089 0.471 . . . . 0.0 111.354 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.87 -73.25 0.26 Allowed Glycine 0 CA--C 1.527 0.81 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.227 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 168.3 -158.26 30.89 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.364 -0.446 . . . . 0.0 113.015 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 62.29 -173.22 0.15 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -126.69 128.03 46.06 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.733 178.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -121.64 94.72 48.36 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.576 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.14 103.18 0.73 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.018 1.812 . . . . 0.0 112.226 178.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -101.41 115.52 30.7 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.336 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.577 HD13 ' HB2' ' A' ' 70' ' ' LEU . 30.2 tp -96.32 108.21 20.68 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.05 0.452 . . . . 0.0 109.938 175.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -81.0 55.32 2.44 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 120.891 0.377 . . . . 0.0 111.585 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -141.12 161.44 53.4 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.17 103.64 1.45 Allowed 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.532 2.155 . . . . 0.0 110.963 163.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.759 HD13 HD12 ' A' ' 34' ' ' ILE . 10.0 mp -75.71 122.86 24.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -169.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.41 HD23 ' HG2' ' A' ' 21' ' ' ARG . 33.1 mt -71.94 106.73 4.35 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.832 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.467 HG12 ' O ' ' A' ' 90' ' ' VAL . 42.3 t 54.14 39.1 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-O 122.2 1.0 . . . . 0.0 109.408 -171.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.753 ' HB2' HG23 ' A' ' 93' ' ' VAL . 70.9 m 56.5 19.85 4.44 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.36 -174.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 46.17 36.17 3.03 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.069 0.938 . . . . 0.0 110.813 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.753 HG23 ' HB2' ' A' ' 91' ' ' SER . 10.7 t -68.07 104.16 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.833 -176.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 70.0 m -74.73 -49.63 20.38 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.37 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 13.0 ttm180 -115.52 138.95 50.51 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.302 0.572 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -132.0 123.5 27.44 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.12 -176.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -147.31 146.75 29.82 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.47 131.81 39.25 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.213 174.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 107' ' ' PRO . 53.9 tp -63.97 128.2 34.77 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -173.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -91.96 112.39 24.3 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.679 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.8 mt -94.75 160.61 14.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.625 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -102.91 -171.44 1.95 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 111.605 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.01 15.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -111.55 -13.18 13.86 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.46 14.06 36.47 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.656 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.57 124.72 43.37 Favored Pre-proline 0 CA--C 1.541 0.625 0 O-C-N 122.647 -0.326 . . . . 0.0 111.279 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.87 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 53.0 Cg_exo -55.71 114.85 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.862 2.374 . . . . 0.0 113.177 177.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -75.61 84.9 2.65 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.347 0.594 . . . . 0.0 112.163 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 42' ' ' ALA . 4.3 mp -81.7 -11.55 59.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.52 174.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -54.79 -33.15 55.58 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.822 176.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.93 -27.73 63.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.15 0.5 . . . . 0.0 110.935 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -79.16 -44.86 21.09 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.235 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.541 0.6 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.595 -175.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.8 p . . . . . 0 N--CA 1.472 0.632 0 CA-C-O 120.894 0.378 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.07 134.58 38.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.85 0.357 . . . . 0.0 111.675 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.482 HG23 ' HB2' ' A' ' 63' ' ' ALA . 22.5 pt -116.39 143.65 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.811 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 58.1 m-85 -126.24 135.63 51.82 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.965 0.412 . . . . 0.0 112.061 -175.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -134.44 115.01 13.49 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.373 173.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.8 mt -90.56 131.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.735 0.302 . . . . 0.0 110.778 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.437 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.9 pt? -147.61 161.2 41.63 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.034 0.445 . . . . 0.0 111.465 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.7 p -69.92 155.66 40.24 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.17 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HB2' ' HB3' ' A' ' 55' ' ' ASN . 38.9 tpt85 -55.61 -33.3 63.85 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.93 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.81 -56.24 21.51 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.904 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -52.88 -47.58 67.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.244 0.545 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -70.43 -41.35 73.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.313 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.99 -52.67 58.51 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 110.735 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.62 -50.76 64.97 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.007 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 22' ' ' PHE . . . -58.46 -43.24 88.79 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.527 177.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -61.56 -39.66 91.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.936 0.398 . . . . 0.0 111.257 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.96 -33.59 65.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 176.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -74.97 -24.23 58.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.514 176.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.56 -10.43 61.91 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.523 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -159.08 141.51 13.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.519 . . . . 0.0 112.403 -178.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.564 ' CZ ' HD22 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -120.32 116.09 24.85 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.402 0.62 . . . . 0.0 111.573 173.411 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 87' ' ' PRO . 10.1 pt-20 -76.64 2.47 14.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.891 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 129.32 166.39 11.9 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.881 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 51.3 m -75.97 176.5 7.84 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.732 -0.275 . . . . 0.0 110.744 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.6 -52.66 63.03 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.035 0.445 . . . . 0.0 111.223 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.52 -50.21 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.286 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 2.4 m-20 -52.46 -60.53 3.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.95 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.49 -28.15 66.78 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.218 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.45 -46.25 70.32 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -88.45 -32.21 18.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.92 -66.25 0.31 Allowed Glycine 0 CA--C 1.526 0.773 0 C-N-CA 120.17 -1.014 . . . . 0.0 114.513 174.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -111.66 162.44 15.19 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.383 0.611 . . . . 0.0 112.256 -172.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.579 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 61.3 mt -66.78 136.27 27.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.606 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -92.14 120.17 32.48 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.012 0.435 . . . . 0.0 111.794 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.71 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 67.1 mt -116.83 169.16 9.6 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.183 175.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.0 m -139.56 154.96 47.75 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.081 0.467 . . . . 0.0 111.712 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.23 113.61 25.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.483 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.3 -107.09 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 114.343 0.497 . . . . 0.0 114.343 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -50.02 -47.08 53.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.043 0.537 . . . . 0.0 112.439 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -57.25 -25.63 59.47 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.34 -49.07 46.12 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 111.002 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.589 ' HB2' HD11 ' A' ' 109' ' ' LEU . 55.8 tt0 -65.85 -36.76 84.35 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.021 0.439 . . . . 0.0 110.856 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.98 -52.61 64.27 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.064 174.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.5 m -57.84 -33.33 68.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.807 0.336 . . . . 0.0 111.128 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.03 -54.48 45.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.902 0.382 . . . . 0.0 110.87 174.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.17 -30.32 69.26 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.024 0.44 . . . . 0.0 111.978 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -76.81 -46.79 23.61 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -110.36 -57.56 2.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.406 0.622 . . . . 0.0 112.385 -174.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.57 ' HB3' HD13 ' A' ' 56' ' ' LEU . 74.6 m-85 -95.2 60.65 2.34 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.423 0.63 . . . . 0.0 111.275 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -73.05 -34.54 66.35 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -174.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 176.91 65.88 0.06 OUTLIER Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.528 -0.844 . . . . 0.0 113.815 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.57 24.63 10.82 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.54 -0.388 . . . . 0.0 111.815 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 55.48 120.85 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 10' ' ' ARG . 15.2 m120 64.74 89.44 0.09 Allowed 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.678 0.752 . . . . 0.0 111.809 -176.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 50' ' ' PHE . 58.5 mt -121.24 111.35 17.27 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.779 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.407 ' O ' HD23 ' A' ' 8' ' ' LEU . 55.4 t -84.99 128.88 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.329 0.585 . . . . 0.0 112.475 -171.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.519 ' HB2' HD11 ' A' ' 99' ' ' LEU . 66.5 tp -97.06 115.1 26.88 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.239 172.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 83.8 mt -88.89 107.74 19.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 0.0 110.971 176.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.14 100.67 10.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.596 178.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.494 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 48.3 t -114.69 132.35 64.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.722 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.9 92.43 1.26 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 171.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.482 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -45.06 -66.78 0.35 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -163.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.8 mm-40 68.69 157.43 0.15 Allowed Pre-proline 0 N--CA 1.473 0.682 0 CA-C-O 121.094 0.473 . . . . 0.0 111.129 -168.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -59.06 -41.34 62.03 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.929 1.752 . . . . 0.0 112.194 171.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.3 mt 70.81 -53.12 0.67 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.946 0.898 . . . . 0.0 111.002 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.17 -77.61 0.05 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.83 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -141.93 7.19 1.83 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 123.16 0.584 . . . . 0.0 110.695 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.546 ' OD2' ' HG3' ' A' ' 86' ' ' ARG . 4.7 m-20 -67.95 -52.1 39.91 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -164.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.8 tp -69.27 97.92 0.99 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.712 0.768 . . . . 0.0 111.419 -170.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -99.23 105.15 17.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.222 -177.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -75.06 101.67 4.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.201 0.524 . . . . 0.0 110.639 176.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.97 102.44 2.41 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.608 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -108.24 86.09 2.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.063 0.459 . . . . 0.0 110.808 175.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -110.54 -150.96 0.47 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.058 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.4 mtm180 -67.54 79.34 0.17 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.308 0.575 . . . . 0.0 110.854 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.47 160.23 22.23 Favored Glycine 0 CA--C 1.525 0.694 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.711 -178.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.87 -34.33 21.92 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.699 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -83.37 132.5 34.99 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 122.433 -0.451 . . . . 0.0 112.055 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -89.42 116.59 27.72 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.828 0.347 . . . . 0.0 110.773 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -98.99 112.33 62.72 Favored Pre-proline 0 N--CA 1.472 0.666 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.71 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 17.6 Cg_exo -66.41 135.5 39.77 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.528 2.152 . . . . 0.0 113.404 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -121.44 154.45 36.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.475 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.579 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 23.8 tp -123.09 140.81 52.64 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.568 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -82.17 -62.46 1.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.546 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 13.0 mtm-85 -71.87 155.76 91.73 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -174.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HA ' ' HA ' ' A' ' 23' ' ' GLU . 51.9 Cg_exo -56.76 115.8 2.74 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.313 2.009 . . . . 0.0 111.516 168.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' A' ' 22' ' ' PHE . 2.5 tt -64.83 116.6 6.49 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 111.715 -171.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.1 mt -78.64 128.96 34.19 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.049 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.52 -33.76 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-O 120.764 0.316 . . . . 0.0 111.483 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 63.7 p -65.46 -28.09 68.97 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.847 0.356 . . . . 0.0 111.603 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.57 -20.11 58.84 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.03 119.42 17.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.949 175.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.494 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 57.0 p -74.93 -63.7 1.2 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -120.45 142.86 48.86 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.613 0.72 . . . . 0.0 112.914 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -132.55 148.59 52.38 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.32 176.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.53 138.79 15.68 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -84.14 127.57 34.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.89 0.376 . . . . 0.0 110.389 177.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 58' ' ' LEU . 94.6 mt -91.62 119.26 31.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.122 0.487 . . . . 0.0 112.223 -176.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.58 154.5 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.02 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -150.07 149.81 30.84 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.201 0.525 . . . . 0.0 112.183 -176.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -100.48 -172.53 2.22 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.631 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.4 7.84 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.04 -10.74 52.3 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.242 0.544 . . . . 0.0 110.204 177.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.5 36.6 58.88 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.79 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 72.5 t -139.44 116.96 8.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.439 ' HA ' ' HB3' ' A' ' 101' ' ' LEU . 36.5 Cg_endo -66.52 98.85 0.41 Allowed 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 121.951 1.767 . . . . 0.0 110.681 167.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -74.84 84.35 2.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.6 0.714 . . . . 0.0 112.44 -169.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.589 HD11 ' HB2' ' A' ' 43' ' ' GLN . 2.2 pp -96.08 5.68 50.57 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.821 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.55 -24.44 56.53 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.436 -0.412 . . . . 0.0 113.639 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -77.56 -11.39 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.147 0.499 . . . . 0.0 111.353 174.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -98.98 -47.64 5.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.179 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 CA--C 1.539 0.556 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -176.805 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.0 p . . . . . 0 N--CA 1.468 0.45 0 CA-C-O 120.894 0.378 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.1 mt -112.96 130.95 55.94 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.962 0.41 . . . . 0.0 111.66 -177.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 70' ' ' LEU . 24.0 pt -105.01 146.17 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.723 174.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.453 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 44.1 m-85 -129.85 164.23 24.58 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.247 0.546 . . . . 0.0 112.148 -172.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE2' ' HG ' ' A' ' 36' ' ' LEU . 24.5 ttmm -156.52 106.76 2.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.809 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.1 mt -88.89 135.9 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.945 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.448 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.0 pt? -152.24 166.93 30.23 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.952 0.406 . . . . 0.0 111.305 -177.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 t -75.68 150.48 37.9 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.858 0.361 . . . . 0.0 111.096 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.545 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . 8.7 tpt180 -56.82 -35.67 69.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.043 0.449 . . . . 0.0 110.839 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.71 -37.47 73.57 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.373 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -75.88 -38.84 57.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.122 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -69.15 -48.43 62.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.33 -37.67 84.13 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.207 -0.308 . . . . 0.0 111.587 175.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.47 -45.29 92.05 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.064 0.459 . . . . 0.0 110.648 174.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.7 -53.02 62.94 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.563 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -61.84 -27.57 68.87 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.887 0.375 . . . . 0.0 111.66 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.63 -51.36 51.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.957 0.408 . . . . 0.0 111.403 176.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 12.6 pt20 -87.88 3.27 49.08 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.85 -1.01 48.79 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.502 -0.38 . . . . 0.0 114.034 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -149.14 149.21 30.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 122.406 -0.467 . . . . 0.0 111.513 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -110.42 132.87 53.8 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.46 0.648 . . . . 0.0 111.872 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -106.61 130.57 54.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.087 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -47.75 -71.28 0.58 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.52 0.568 . . . . 0.0 114.52 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 44.3 t 179.4 159.34 0.68 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.713 0.405 . . . . 0.0 110.143 -178.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -55.19 35.45 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.3 p -63.15 -33.32 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 111.813 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.576 ' HB2' ' HB3' ' A' ' 25' ' ' SER . 22.1 t0 -62.1 -58.44 7.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.251 0.548 . . . . 0.0 110.481 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.97 -33.83 76.61 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.04 -37.95 89.31 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -75.99 -34.57 59.75 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.755 0.312 . . . . 0.0 110.771 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 165.12 -68.86 0.2 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 120.151 -1.023 . . . . 0.0 114.566 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.576 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 52.9 m-85 -145.45 141.84 28.73 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 122.42 -0.459 . . . . 0.0 111.738 -167.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 62.1 mt -50.96 107.09 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -174.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -80.53 127.93 33.01 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.281 0.562 . . . . 0.0 111.474 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HG ' ' HE2' ' A' ' 6' ' ' LYS . 7.3 mp -91.32 -46.33 8.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.5 m 66.5 97.06 0.05 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.158 0.504 . . . . 0.0 110.973 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.52 155.92 19.1 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.74 -119.92 18.92 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.721 -0.672 . . . . 0.0 113.939 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.404 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.7 mp0 -59.74 -40.0 86.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.118 0.485 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -67.39 -29.13 68.56 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.141 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.19 -50.87 59.39 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.138 0.494 . . . . 0.0 110.895 176.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.427 HE21 HD11 ' A' ' 109' ' ' LEU . 5.4 tp-100 -57.41 -47.52 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.251 175.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.539 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 33.1 tt0 -61.35 -48.36 81.64 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.302 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -60.82 -37.86 83.43 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 120.952 0.405 . . . . 0.0 111.162 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.413 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.43 -40.84 83.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.74 175.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.12 -25.62 61.8 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.024 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.539 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 65.1 mttm -74.78 -69.43 0.46 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.39 0.614 . . . . 0.0 111.669 177.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.3 m0 -75.0 -60.68 2.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.503 -0.771 . . . . 0.0 112.4 -170.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.541 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 45.0 m-85 -82.92 -66.33 0.9 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.575 -170.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 70.81 -65.54 0.33 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -151.48 56.19 0.45 Allowed Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.57 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.627 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.6 mt-30 -99.81 -164.66 1.14 Allowed 'General case' 0 CA--C 1.539 0.544 0 O-C-N 122.774 -0.251 . . . . 0.0 110.834 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.67 -67.19 0.89 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.545 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 15.4 p-10 -97.33 67.7 2.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.857 0.837 . . . . 0.0 111.728 -168.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.627 HD21 ' HB2' ' A' ' 53' ' ' GLN . 37.7 mt -94.71 124.78 38.95 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.542 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 t -110.65 148.64 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.26 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.0 tt -122.27 118.77 29.33 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.824 0.345 . . . . 0.0 110.799 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.6 mt -90.85 131.56 36.41 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.56 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -128.53 125.08 37.59 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.904 0.383 . . . . 0.0 111.519 -178.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.99 134.5 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 120.869 0.366 . . . . 0.0 111.128 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -74.53 138.4 43.09 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 175.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.416 ' O ' ' HG ' ' A' ' 66' ' ' LEU . . . -48.39 -70.51 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.496 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 28.2 mt-10 61.24 167.98 0.09 OUTLIER Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.496 ' HD2' ' HB3' ' A' ' 64' ' ' GLU . 82.8 Cg_exo -52.24 5.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.503 0 C-N-CA 123.711 2.941 . . . . 0.0 116.356 176.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 63' ' ' ALA . 4.3 pp -88.35 10.34 20.23 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.315 -0.865 . . . . 0.0 111.656 178.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -71.83 27.13 0.63 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.504 0.562 . . . . 0.0 114.504 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.17 -35.4 9.67 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.23 -0.571 . . . . 0.0 110.247 173.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -78.76 -12.69 60.03 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.13 175.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 4' ' ' ILE . 51.5 tp -114.0 134.19 55.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.814 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -137.25 134.57 36.33 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.966 0.413 . . . . 0.0 111.416 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.515 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 73.0 m95 -83.66 89.41 7.12 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.97 0.414 . . . . 0.0 110.721 177.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.39 117.6 31.2 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.097 0.475 . . . . 0.0 112.131 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.436 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -89.49 114.12 25.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.037 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.3 m -117.78 36.24 4.38 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -164.26 -36.38 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 0.0 111.657 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 141.17 100.58 0.42 Allowed Glycine 0 CA--C 1.526 0.723 0 C-N-CA 121.182 -0.533 . . . . 0.0 113.038 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.8 -47.05 3.72 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.18 104.45 1.82 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 122.414 -0.463 . . . . 0.0 111.484 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.515 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 50.4 mtm180 -92.9 107.82 19.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.962 0.411 . . . . 0.0 111.365 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -84.31 114.68 56.25 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.408 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.51 111.45 1.66 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.406 2.071 . . . . 0.0 112.245 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.576 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 57.8 m170 -106.6 133.93 50.52 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.589 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.8 tp -100.22 120.42 39.87 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.924 0.392 . . . . 0.0 110.293 177.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -79.52 7.09 8.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -174.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -145.43 155.43 53.64 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 122.357 -0.214 . . . . 0.0 111.116 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.31 135.75 61.06 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.683 2.256 . . . . 0.0 113.072 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 61.5 tp -80.49 88.72 5.62 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.053 0.454 . . . . 0.0 111.232 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.2 mt -61.36 141.84 57.33 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.282 -0.261 . . . . 0.0 110.532 176.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 87.9 t -58.17 -27.45 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.05 0.453 . . . . 0.0 111.138 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.2 t -65.69 -23.7 66.83 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.36 -21.12 53.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.782 0.325 . . . . 0.0 111.536 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.8 t -76.73 87.86 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.05 0.453 . . . . 0.0 110.929 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.529 HG22 ' HG3' ' A' ' 95' ' ' ARG . 97.8 m -59.87 -48.55 81.23 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.115 -178.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.529 ' HG3' HG22 ' A' ' 94' ' ' THR . 69.2 mtm180 -134.12 148.13 50.94 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.633 0.254 . . . . 0.0 111.345 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -157.74 153.33 26.4 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.749 0.309 . . . . 0.0 111.609 177.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -169.18 151.26 4.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -73.14 126.31 29.73 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.74 174.83 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -170.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 23.4 t70 -107.91 129.16 55.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.616 -177.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.581 HD21 HD12 ' A' ' 56' ' ' LEU . 80.9 mt -96.56 152.06 18.99 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.993 0.425 . . . . 0.0 111.91 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.658 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 28.1 t70 -86.3 174.71 8.88 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.92 177.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.33 65.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -96.27 9.42 41.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.139 0.495 . . . . 0.0 111.052 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.503 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 93.52 -33.98 4.86 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 121.243 -0.503 . . . . 0.0 113.658 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.8 t -54.41 122.82 40.13 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.436 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 31.2 Cg_exo -59.84 103.97 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 112.264 176.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.658 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 83.6 mm-40 -76.55 68.36 2.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.444 0.64 . . . . 0.0 111.77 -177.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 112' ' ' HIS . 2.3 pp -100.32 5.39 44.47 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.538 176.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.93 -49.3 72.26 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.482 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.16 -19.62 62.4 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.215 0.531 . . . . 0.0 111.079 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . 0.455 ' HB3' ' O ' ' A' ' 109' ' ' LEU . 73.3 t60 -76.73 -30.1 56.48 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.349 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.443 HD22 ' CZ ' ' A' ' 5' ' ' TYR . 30.5 mt . . . . . 0 CA--C 1.542 0.641 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.131 -179.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 121.1 0.476 . . . . 0.0 110.752 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.8 mt -87.8 113.77 23.78 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -174.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.566 HD12 HD22 ' A' ' 36' ' ' LEU . 25.7 pt -98.51 141.79 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 170.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.511 ' HB3' HD11 ' A' ' 58' ' ' LEU . 92.2 m-85 -117.38 147.4 42.68 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.657 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 77.7 tttt -151.93 118.1 5.56 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -93.19 149.57 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-O 120.96 0.41 . . . . 0.0 111.678 -176.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -160.27 171.44 19.16 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.99 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -79.89 145.65 32.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.86 0.362 . . . . 0.0 111.148 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.43 -29.99 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.524 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.03 -59.48 5.29 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.381 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.86 -34.31 74.4 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.823 0.344 . . . . 0.0 111.639 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -64.32 -47.73 78.3 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.912 0.387 . . . . 0.0 111.869 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.23 -40.12 86.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.464 0.65 . . . . 0.0 110.125 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.68 72.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.027 174.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.91 97.94 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 174.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.54 -35.83 78.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.294 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.17 -27.43 63.82 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.925 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -109.28 -0.78 18.98 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.011 0.434 . . . . 0.0 111.61 176.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.13 -0.53 46.46 Favored Glycine 0 CA--C 1.53 1.013 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 176.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -136.16 155.27 50.39 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.948 -0.737 . . . . 0.0 111.582 -175.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.657 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 44.1 t80 -128.95 160.8 31.54 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.072 172.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.557 ' HB3' HD13 ' A' ' 34' ' ' ILE . 67.1 mt-10 73.96 -168.39 0.11 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.599 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.21 22.44 70.88 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.304 -173.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.3 t -88.39 -177.23 5.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.896 0.478 . . . . 0.0 111.573 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.43 -42.49 32.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.1 t -56.79 -39.61 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 120.903 0.382 . . . . 0.0 111.717 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.34 -50.83 58.34 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.088 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.88 -27.26 68.08 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.79 0.329 . . . . 0.0 111.688 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.44 -56.03 4.89 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.069 0.461 . . . . 0.0 112.039 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -80.49 -29.71 37.35 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 118.25 -27.42 7.35 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.975 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -152.08 166.5 31.42 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.212 0.529 . . . . 0.0 111.597 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.557 HD13 ' HB3' ' A' ' 23' ' ' GLU . 50.4 mt -80.18 149.44 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.798 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -111.86 121.19 44.36 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.007 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.622 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 6.2 mp -119.28 -175.42 2.93 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 171.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.9 m -146.71 153.4 40.21 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.05 -166.83 1.7 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.824 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.8 -69.99 1.11 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 114.138 0.415 . . . . 0.0 114.138 -175.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.18 88.25 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.922 0.392 . . . . 0.0 111.59 -177.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -61.34 -46.24 91.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.489 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -62.07 -42.59 99.36 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.742 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -59.9 -48.72 80.55 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 120.989 0.424 . . . . 0.0 111.555 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -73.12 -41.29 64.16 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.4 m -59.5 -42.0 91.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.973 0.416 . . . . 0.0 111.104 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.444 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.87 -42.49 89.55 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.063 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.21 68.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -82.44 -63.22 1.42 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.07 0.462 . . . . 0.0 112.058 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -74.31 -40.13 62.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -172.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -117.02 34.45 5.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.128 0.489 . . . . 0.0 110.907 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 51' ' ' ARG . 2.9 ptm180 -36.06 -52.7 0.77 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -176.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.633 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -156.29 47.25 0.49 Allowed Glycine 0 CA--C 1.522 0.524 0 C-N-CA 120.858 -0.687 . . . . 0.0 113.495 -176.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.581 ' HB2' HD21 ' A' ' 56' ' ' LEU . 64.2 mt-30 -87.5 158.5 18.92 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.722 0.296 . . . . 0.0 110.893 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.38 128.89 34.99 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 67.56 84.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.828 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.581 HD21 ' HB2' ' A' ' 53' ' ' GLN . 96.1 mt -112.69 129.83 56.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.531 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.419 ' O ' HD23 ' A' ' 8' ' ' LEU . 60.3 t -102.64 130.79 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.057 0.456 . . . . 0.0 111.439 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.6 tp -99.44 104.03 15.85 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 175.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.427 HD22 HG11 ' A' ' 93' ' ' VAL . 82.7 mt -76.29 109.81 10.29 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.075 0.464 . . . . 0.0 111.376 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.474 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -101.12 115.84 31.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.41 175.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 4' ' ' ILE . 51.8 t -126.24 131.86 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.636 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 18.6 tt0 -92.22 105.28 17.53 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.17 0.509 . . . . 0.0 111.985 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.58 84.85 7.06 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.425 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.595 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 41.2 mt-10 -80.58 -44.8 1.32 Allowed Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 178.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 10.9 Cg_endo -53.9 -62.27 0.33 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.828 1.685 . . . . 0.0 112.294 177.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 70' ' ' LEU . 18.6 tp 57.13 22.92 7.97 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.23 0.538 . . . . 0.0 111.985 172.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -93.77 -83.31 1.57 Allowed Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.501 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -102.34 5.56 39.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.029 0.442 . . . . 0.0 111.167 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.516 ' O ' HD12 ' A' ' 84' ' ' LEU . 4.0 p-10 -92.79 -64.17 1.13 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.182 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.58 ' HB3' HD12 ' A' ' 66' ' ' LEU . 42.0 tp -107.89 147.7 30.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.916 0.388 . . . . 0.0 111.09 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -136.63 101.04 4.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.006 0.432 . . . . 0.0 111.94 -174.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -70.28 119.82 15.03 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -158.32 144.63 17.27 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.602 -172.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.46 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -149.51 158.1 43.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.251 0.548 . . . . 0.0 112.407 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.6 m -154.78 126.74 7.64 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.176 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 76' ' ' ARG . 3.8 mpt_? 69.83 -59.99 0.49 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 176.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.2 -15.38 44.16 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.352 0.501 . . . . 0.0 114.352 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 79.2 -45.07 2.74 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.608 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.81 134.86 57.51 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.931 0.396 . . . . 0.0 112.047 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.46 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 83.6 mtt180 -79.1 110.89 14.77 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.153 -177.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 80.2 m-85 -95.17 117.64 66.69 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-O 120.756 0.313 . . . . 0.0 111.712 -177.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 81' ' ' PHE . 18.5 Cg_exo -66.82 102.19 0.61 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.661 2.24 . . . . 0.0 112.374 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -90.94 115.4 27.94 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.133 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.516 HD12 ' O ' ' A' ' 69' ' ' ASP . 55.2 tp -105.24 130.57 53.36 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.707 0.289 . . . . 0.0 110.543 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -110.32 37.11 2.82 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 20.5 ptp180 -167.55 138.42 2.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 O-C-N 122.452 -0.155 . . . . 0.0 110.986 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 26.8 Cg_exo -62.48 149.33 91.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 122.721 2.281 . . . . 0.0 113.046 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -108.99 118.56 37.11 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.33 0.586 . . . . 0.0 111.282 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -71.04 135.56 47.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.058 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 30.0 m -57.88 -35.24 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -172.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -72.54 -3.77 26.56 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.729 0.3 . . . . 0.0 111.722 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -98.01 -11.86 22.55 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.808 0.337 . . . . 0.0 111.77 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.427 HG11 HD22 ' A' ' 59' ' ' LEU . 57.6 t -66.61 124.81 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 O-C-N 122.319 -0.238 . . . . 0.0 111.407 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 40.8 m -59.72 -38.83 82.74 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.768 0.318 . . . . 0.0 111.645 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -160.85 143.13 12.55 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.301 0.572 . . . . 0.0 112.231 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.3 pt-20 -106.7 84.07 1.95 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.489 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.52 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -74.6 84.31 2.06 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.216 0.532 . . . . 0.0 112.209 -175.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 102.22 1.59 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.573 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 pp -116.15 168.37 10.17 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -122.87 176.12 6.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.521 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.633 HD11 ' HA2' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -158.74 179.07 9.44 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.816 -179.221 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -113.87 170.28 8.38 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.478 0.656 . . . . 0.0 112.127 170.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.75 94.02 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.366 -178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 91.25 -6.58 0.26 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.791 0.836 . . . . 0.0 109.678 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -60.19 -39.89 96.54 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.501 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 t 67.13 141.14 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 123.951 0.442 . . . . 0.0 112.153 169.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.558 ' HD3' HD13 ' A' ' 101' ' ' LEU . 53.2 Cg_exo -35.01 101.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 123.138 2.559 . . . . 0.0 113.888 -173.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -70.4 80.22 0.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.567 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.4 mp -79.39 -23.56 43.2 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.307 -0.406 . . . . 0.0 112.072 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.59 -41.5 26.17 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.635 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -78.05 -13.67 59.79 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -95.58 -13.12 24.67 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.615 0.245 . . . . 0.0 111.173 179.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 42.7 mt . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -175.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 53.3 p . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.7 mt -81.98 105.96 13.51 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.987 -0.446 . . . . 0.0 111.406 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.44 ' CG2' ' HB3' ' A' ' 36' ' ' LEU . 13.6 mt -92.35 142.92 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.19 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -130.72 119.42 22.33 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.664 0.269 . . . . 0.0 111.609 -177.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 35' ' ' HIS . 33.8 ttpt -127.24 123.06 35.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.651 0.262 . . . . 0.0 111.673 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.479 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.1 mp -91.69 138.14 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -178.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.42 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.8 pt? -149.69 174.54 12.46 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.189 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.413 ' OG ' ' HG2' ' A' ' 12' ' ' GLU . 83.9 p -82.48 151.97 26.28 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.943 -0.473 . . . . 0.0 111.063 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -30.06 64.37 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.832 0.348 . . . . 0.0 110.497 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.37 39.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.26 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HG2' ' OG ' ' A' ' 9' ' ' SER . 12.3 mm-40 -58.29 -43.55 88.11 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 111.144 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.52 ' CH2' HG13 ' A' ' 90' ' ' VAL . 28.4 t-105 -62.74 -51.74 65.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.678 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.56 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 12.4 t70 -59.44 -47.42 85.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.327 0.584 . . . . 0.0 110.784 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.41 -46.71 76.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.467 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.72 74.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.56 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 10.4 mtmp? -65.71 -27.92 68.68 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.683 0.278 . . . . 0.0 110.958 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.27 83.68 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.135 0.493 . . . . 0.0 111.091 173.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -80.23 -26.53 39.04 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.235 0.541 . . . . 0.0 110.856 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.06 -10.77 51.87 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.447 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HG2' HD13 ' A' ' 89' ' ' LEU . 24.8 mtt-85 -135.73 121.68 19.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.59 -0.359 . . . . 0.0 110.821 -178.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -78.6 86.67 4.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 172.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.11 80.27 9.24 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.194 0.521 . . . . 0.0 112.089 -174.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.67 -135.35 48.68 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.58 -0.737 . . . . 0.0 114.565 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.494 ' O ' ' HB3' ' A' ' 28' ' ' ASP . 46.5 t 170.42 177.48 0.05 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.627 0.771 . . . . 0.0 110.25 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.41 -49.12 77.24 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 122.003 -0.436 . . . . 0.0 111.865 -179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.493 HG22 ' NE2' ' A' ' 35' ' ' HIS . 10.7 p -65.33 -24.52 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 111.597 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.494 ' HB3' ' O ' ' A' ' 25' ' ' SER . 0.3 OUTLIER -64.12 -53.66 46.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.758 175.094 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.27 -30.61 68.42 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 120.621 0.248 . . . . 0.0 111.082 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.17 77.92 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.868 0.366 . . . . 0.0 111.709 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.51 ' HB3' ' CD1' ' A' ' 33' ' ' PHE . 3.5 m-20 -87.91 -29.67 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.103 0.477 . . . . 0.0 111.566 173.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.18 -6.67 81.28 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.902 -170.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.608 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -151.45 143.81 24.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.225 0.61 . . . . 0.0 111.092 -177.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mt -60.53 130.42 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -168.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.493 ' NE2' HG22 ' A' ' 27' ' ' VAL . 33.7 m-70 -72.45 140.12 48.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.736 170.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB3' ' CG2' ' A' ' 4' ' ' ILE . 3.4 mp -145.61 -64.51 0.32 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.68 0.276 . . . . 0.0 110.714 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 56.2 m 78.71 160.29 0.19 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.81 177.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -97.72 177.58 5.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.864 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -41.86 -47.97 5.13 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 114.677 0.631 . . . . 0.0 114.677 -175.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -54.61 -69.02 0.14 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.426 0.631 . . . . 0.0 111.781 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 22.2 mp0 -68.91 -20.09 64.22 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.888 -175.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.96 -56.52 8.71 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.698 0.285 . . . . 0.0 111.358 178.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.461 ' NE2' ' HA ' ' A' ' 108' ' ' GLN . 29.3 tt0 -61.74 -39.82 92.92 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 111.728 0.269 . . . . 0.0 111.728 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -58.97 -56.4 22.75 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.979 0.419 . . . . 0.0 110.935 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -56.02 -34.02 65.44 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.122 176.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.54 -49.42 73.55 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.624 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.24 -33.07 74.69 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.054 0.454 . . . . 0.0 111.911 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -77.05 -53.03 8.31 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.36 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -88.79 -42.26 12.02 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -174.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -112.74 57.12 0.66 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.169 0.509 . . . . 0.0 110.713 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -4.54 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -172.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.88 73.63 0.02 OUTLIER Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.372 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.573 ' HB2' HD21 ' A' ' 56' ' ' LEU . 88.0 mt-30 -107.3 26.0 10.73 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 121.452 0.644 . . . . 0.0 110.996 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 64.46 -78.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.49 63.22 7.22 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.576 0.703 . . . . 0.0 111.367 -172.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.693 HD12 HD21 ' A' ' 101' ' ' LEU . 52.2 mt -88.5 138.92 31.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.606 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' HD23 ' A' ' 8' ' ' LEU . 59.7 t -123.51 141.92 42.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.648 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 8.8 tt -109.38 115.4 29.88 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.899 0.38 . . . . 0.0 110.615 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.1 108.59 13.82 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.87 0.366 . . . . 0.0 111.317 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.04 110.38 22.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.5 t -120.01 116.68 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.45 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.445 ' HG2' ' OG1' ' A' ' 94' ' ' THR . 11.8 pt-20 -79.41 103.38 9.29 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.594 0.711 . . . . 0.0 110.902 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.16 40.62 0.27 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.142 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -75.85 -45.89 3.98 Favored Pre-proline 0 CA--C 1.548 0.888 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -83.75 -157.23 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 122.216 1.944 . . . . 0.0 112.374 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 69' ' ' ASP . 90.5 mt 67.83 -55.38 0.49 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.366 1.066 . . . . 0.0 112.072 -177.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.08 -102.94 1.3 Allowed Glycine 0 CA--C 1.528 0.906 0 CA-C-N 116.213 -0.449 . . . . 0.0 113.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -69.82 -13.92 62.5 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 66' ' ' LEU . 58.1 m-20 -67.27 -17.62 64.87 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.5 tp -123.33 149.88 44.32 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.456 ' NZ ' ' OH ' ' A' ' 85' ' ' TYR . 8.1 ttpm? -149.25 128.36 12.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.925 0.393 . . . . 0.0 111.308 171.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.416 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 53.4 m95 -72.55 86.79 1.19 Allowed 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -86.17 128.89 34.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.961 -169.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.586 ' HB2' HH11 ' A' ' 80' ' ' ARG . . . -76.58 152.01 36.09 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.482 0.658 . . . . 0.0 112.729 -176.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.0 t -130.93 -178.64 4.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.0 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -55.44 103.45 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.913 0.485 . . . . 0.0 111.682 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.25 -16.62 5.7 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.473 -0.394 . . . . 0.0 112.916 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.45 -2.64 59.18 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.324 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.51 140.35 57.99 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.704 -0.292 . . . . 0.0 111.757 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.586 HH11 ' HB2' ' A' ' 74' ' ' ALA . 24.9 mmm180 -102.66 111.91 24.44 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.734 0.302 . . . . 0.0 111.262 -177.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -107.45 114.15 61.06 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-O 120.637 0.256 . . . . 0.0 111.364 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 37' ' ' SER . 43.6 Cg_endo -67.37 103.09 0.75 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.35 2.034 . . . . 0.0 112.819 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 31.3 m80 -98.91 129.82 45.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.928 176.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.43 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 36.3 tp -95.07 137.26 34.37 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.456 ' OH ' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 m-85 -105.61 12.91 30.65 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -173.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.43 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 44.4 mtm180 -141.67 154.44 66.14 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 122.664 0.386 . . . . 0.0 110.695 173.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.6 132.63 52.96 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.532 2.155 . . . . 0.0 113.105 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.6 tp -79.3 105.45 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.863 0.363 . . . . 0.0 111.707 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.427 HD13 ' HG2' ' A' ' 21' ' ' ARG . 3.7 mm? -63.98 123.53 19.24 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.238 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.52 HG13 ' CH2' ' A' ' 13' ' ' TRP . 76.3 t -56.2 -39.44 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.955 0.407 . . . . 0.0 111.815 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.6 t -72.96 -4.53 32.74 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -99.56 -11.49 20.96 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 120.998 0.428 . . . . 0.0 111.378 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -69.25 135.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-O 120.933 0.397 . . . . 0.0 111.706 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.445 ' OG1' ' HG2' ' A' ' 62' ' ' GLU . 61.3 m -65.15 -50.0 67.67 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.064 0.459 . . . . 0.0 111.597 -179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -155.31 143.09 19.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.284 0.564 . . . . 0.0 111.671 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.4 pt-20 -97.15 86.49 3.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.335 171.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.486 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -75.98 86.45 2.9 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -171.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -66.81 139.28 57.77 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.924 172.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.455 HD23 ' N ' ' A' ' 99' ' ' LEU . 2.0 pt? -141.2 145.11 35.21 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.143 0.497 . . . . 0.0 112.088 -177.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.63 131.82 34.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.395 172.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.693 HD21 HD12 ' A' ' 56' ' ' LEU . 88.4 mt -71.14 149.84 46.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.119 0.485 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.82 166.15 3.55 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.639 175.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.84 66.8 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.126 0.489 . . . . 0.0 111.7 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -83.41 -10.93 58.11 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.501 0.667 . . . . 0.0 110.078 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.94 18.89 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.695 -0.684 . . . . 0.0 113.008 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 73.4 t -103.91 123.43 41.07 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 83.04 1.04 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 170.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.461 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 2.8 pt20 -80.25 115.37 19.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.433 0.635 . . . . 0.0 112.227 -174.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -88.63 -29.92 19.59 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -47.24 -46.12 21.41 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.414 -0.422 . . . . 0.0 113.556 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -64.93 -40.29 94.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.858 0.361 . . . . 0.0 111.575 177.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -79.02 -24.17 43.86 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -174.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 46.6 mt . . . . . 0 CA--C 1.542 0.658 0 O-C-N 122.321 -0.237 . . . . 0.0 111.287 -178.419 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.448 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 pmm? . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m 72.48 -48.53 0.68 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.321 0.649 . . . . 0.0 112.663 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -69.61 96.1 0.91 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.711 173.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 pt -92.2 147.32 5.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.751 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.532 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 43.2 m-85 -119.79 147.44 44.64 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -170.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -126.79 123.59 37.74 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.553 171.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.0 mt -96.56 130.1 45.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.731 0.3 . . . . 0.0 111.468 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -147.71 174.55 11.69 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.811 176.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.4 t -79.79 143.97 33.97 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.797 0.332 . . . . 0.0 111.301 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -55.92 -44.1 78.01 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.68 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.5 -37.72 57.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 111.927 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.56 -41.64 65.54 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.131 0.491 . . . . 0.0 110.893 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -64.45 -49.44 71.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.976 -0.557 . . . . 0.0 112.166 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -58.03 -39.53 78.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.717 0.294 . . . . 0.0 111.559 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.87 -50.64 71.43 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.954 0.407 . . . . 0.0 111.241 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -41.7 89.3 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.163 0.506 . . . . 0.0 111.402 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.402 ' HA ' HG21 ' A' ' 90' ' ' VAL . 24.5 ttmm -63.48 -31.08 72.14 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.266 178.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.08 -40.73 78.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.011 0.434 . . . . 0.0 111.08 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -76.41 -30.55 57.49 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.9 1.14 82.81 Favored Glycine 0 CA--C 1.529 0.94 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.053 -171.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -141.07 146.56 37.3 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.864 0.364 . . . . 0.0 111.966 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -128.04 99.75 5.61 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.12 0.486 . . . . 0.0 110.283 173.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 23' ' ' GLU . 3.6 pm0 -71.83 163.89 27.0 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.068 0.461 . . . . 0.0 111.563 177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.73 111.46 4.2 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.229 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.4 t -67.19 158.39 31.43 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.716 0.293 . . . . 0.0 111.645 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.09 -37.12 43.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.975 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.5 t -62.88 -49.04 85.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.105 0.479 . . . . 0.0 111.292 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.492 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 8.2 m-20 -62.71 -46.23 89.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.57 -33.24 75.45 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.666 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.29 -37.09 86.25 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.978 0.418 . . . . 0.0 111.78 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -81.42 -51.63 8.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.146 0.498 . . . . 0.0 111.291 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 153.46 71.44 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.416 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 68.64 -176.69 0.21 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.897 0.479 . . . . 0.0 111.597 -177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.66 103.11 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 121.302 0.572 . . . . 0.0 111.618 -175.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 8.2 p80 -86.55 106.45 17.55 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.23 0.538 . . . . 0.0 112.218 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -91.55 166.31 12.9 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 172.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.1 p -142.72 140.58 31.54 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.902 -0.499 . . . . 0.0 112.163 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.03 157.58 34.83 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.942 176.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.62 -48.3 8.89 Favored Glycine 0 CA--C 1.532 1.147 0 N-CA-C 114.383 0.513 . . . . 0.0 114.383 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -66.02 -42.67 89.37 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.188 0.518 . . . . 0.0 111.516 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.88 -40.72 91.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.484 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.41 76.49 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.62 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.736 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 13.1 tm0? -56.58 -50.33 72.27 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -58.06 -56.79 17.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.16 0.505 . . . . 0.0 111.837 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 34.3 m -59.78 -31.24 69.5 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.026 0.441 . . . . 0.0 111.115 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 107' ' ' PRO . . . -62.68 -45.2 93.91 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.103 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.551 ' HA ' HG13 ' A' ' 106' ' ' VAL . . . -66.0 -33.71 76.42 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.976 0.417 . . . . 0.0 111.855 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.7 -54.05 6.24 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -106.82 -40.7 5.42 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -169.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.467 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.2 m-85 -85.64 2.5 44.94 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.072 0.463 . . . . 0.0 112.186 -173.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.654 ' HA ' ' HD3' ' A' ' 107' ' ' PRO . 45.0 ptt85 -57.25 141.15 47.65 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.547 175.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.48 -17.81 22.58 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 121.063 -0.589 . . . . 0.0 113.928 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -87.55 97.45 10.86 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.282 0.563 . . . . 0.0 111.287 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.18 54.12 0.97 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.049 0.452 . . . . 0.0 111.894 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -158.8 36.37 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.42 0.628 . . . . 0.0 110.57 177.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -95.66 155.42 16.75 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.503 -173.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 62.1 t -123.75 130.27 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.328 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 21.1 tp -98.4 103.93 15.92 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.639 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.532 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 79.8 mt -86.89 113.9 23.08 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.51 124.45 40.5 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.926 0.393 . . . . 0.0 111.963 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.0 t -124.65 132.01 71.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 122.788 0.435 . . . . 0.0 110.887 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.463 ' O ' ' N ' ' A' ' 64' ' ' GLU . 38.7 mt-10 -79.4 66.1 4.76 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . 34.16 -78.41 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.1 mm-40 73.18 132.72 0.04 OUTLIER Pre-proline 0 N--CA 1.475 0.775 0 C-N-CA 123.705 0.802 . . . . 0.0 111.779 -170.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 64' ' ' GLU . 12.8 Cg_exo -70.38 26.16 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.574 2.85 . . . . 0.0 114.903 -174.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.85 59.41 4.12 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.387 0.613 . . . . 0.0 111.756 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' A' ' 70' ' ' LEU . . . -58.76 -11.49 10.99 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 115.751 -0.659 . . . . 0.0 114.062 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -62.81 -42.32 99.67 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.723 0.409 . . . . 0.0 111.831 174.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -105.61 -30.95 9.17 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.485 HD11 ' HB2' ' A' ' 82' ' ' PRO . 57.5 tp -104.7 101.8 11.41 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.954 0.407 . . . . 0.0 110.762 176.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -114.04 124.04 51.16 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -69.97 80.09 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.567 0.699 . . . . 0.0 109.132 171.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -100.5 137.39 38.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.236 -169.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -74.81 95.05 2.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.45 -178.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 t -72.74 146.39 46.45 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.088 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 57.22 20.21 5.53 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.843 0.354 . . . . 0.0 111.886 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.03 42.3 99.66 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.351 -176.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.02 -99.69 0.32 Allowed Glycine 0 CA--C 1.531 1.059 0 C-N-CA 120.745 -0.741 . . . . 0.0 114.027 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -80.11 145.1 32.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -86.31 96.0 9.83 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.978 0.418 . . . . 0.0 111.6 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.7 129.14 39.19 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.485 ' HB2' HD11 ' A' ' 70' ' ' LEU . 33.2 Cg_endo -64.76 100.34 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.515 2.143 . . . . 0.0 112.723 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -93.38 126.88 38.75 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.471 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 tp -92.5 116.05 28.64 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.402 174.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -84.22 22.32 1.24 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -149.77 156.92 38.64 Favored Pre-proline 0 CA--C 1.54 0.569 0 O-C-N 122.28 -0.262 . . . . 0.0 110.552 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -50.24 140.91 32.7 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 122.879 2.386 . . . . 0.0 113.852 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -89.45 98.1 11.58 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.079 0.466 . . . . 0.0 111.061 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.55 132.58 47.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.784 0.326 . . . . 0.0 110.754 176.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.402 HG21 ' HA ' ' A' ' 17' ' ' LYS . 98.2 t -59.7 -39.23 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 120.934 0.397 . . . . 0.0 111.302 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 64.1 m -68.33 -8.96 44.45 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -88.71 -28.17 20.73 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.031 0.444 . . . . 0.0 110.967 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.3 t -66.37 143.4 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.438 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.465 HG22 ' HG3' ' A' ' 95' ' ' ARG . 93.3 m -74.05 -65.08 0.88 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.723 0.297 . . . . 0.0 111.192 179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 94' ' ' THR . 37.3 mtp85 -148.15 159.55 43.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.143 0.496 . . . . 0.0 111.853 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -110.37 162.1 14.98 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.703 175.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.9 107.77 3.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.619 0.247 . . . . 0.0 111.474 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -60.2 120.1 9.14 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.011 0.434 . . . . 0.0 110.612 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 100' ' ' ASP . 2.8 tm? -111.27 132.88 54.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.196 -172.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.443 ' N ' HD13 ' A' ' 99' ' ' LEU . 4.2 t70 -124.26 -179.27 4.38 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 120.903 0.382 . . . . 0.0 111.499 -177.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 48.1 mt -94.66 165.76 12.35 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -173.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.569 ' HB3' ' HB2' ' A' ' 108' ' ' GLN . 5.7 p-10 -106.29 -162.99 0.89 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.109 0.481 . . . . 0.0 111.174 174.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.48 -30.59 68.65 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -89.72 -3.31 58.26 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.868 0.366 . . . . 0.0 111.23 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.82 19.18 68.42 Favored Glycine 0 CA--C 1.525 0.685 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.956 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.551 HG13 ' HA ' ' A' ' 47' ' ' ALA . 74.2 t -99.8 137.76 20.24 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 122.862 0.465 . . . . 0.0 110.927 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.654 ' HD3' ' HA ' ' A' ' 51' ' ' ARG . 76.0 Cg_exo -51.66 101.32 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.152 1.901 . . . . 0.0 111.15 171.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 102' ' ' ASP . 8.9 tp-100 -79.26 82.79 5.37 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -167.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.736 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 8.3 mp -83.98 -14.03 51.8 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.785 171.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.623 ' HA2' HD22 ' A' ' 115' ' ' LEU . . . -57.14 -41.5 92.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.891 176.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -83.21 -29.1 28.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.952 0.352 . . . . 0.0 111.952 174.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 109' ' ' LEU . 75.8 t60 -76.11 -21.08 57.06 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.891 0.377 . . . . 0.0 111.817 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.565 ' HB2' HD13 ' A' ' 115' ' ' LEU . 72.7 mt -113.64 -171.77 1.95 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.151 0.5 . . . . 0.0 111.307 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -83.38 16.94 2.29 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -175.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.623 HD22 ' HA2' ' A' ' 110' ' ' GLY . 9.9 mp -64.57 -20.14 66.06 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 CA--C 1.54 0.585 0 CA-C-O 121.0 0.429 . . . . 0.0 110.975 174.639 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ttt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.704 0.287 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.545 ' O ' ' HA ' ' A' ' 62' ' ' GLU . 74.7 p -142.77 123.1 13.86 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 122.419 0.288 . . . . 0.0 110.849 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.539 HD12 ' HB1' ' A' ' 60' ' ' ALA . 3.8 mm? -83.5 122.86 29.11 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.254 0.549 . . . . 0.0 112.281 -176.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 61' ' ' VAL . 15.6 pt -108.74 143.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.72 171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.504 ' HB3' HD11 ' A' ' 58' ' ' LEU . 40.0 m-85 -120.46 144.53 47.93 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -166.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -150.29 120.13 7.1 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.232 170.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 59.7 mt -92.49 129.74 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.942 0.401 . . . . 0.0 111.928 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -119.51 161.35 20.72 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.067 0.46 . . . . 0.0 111.731 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 82.5 p -83.51 142.48 30.87 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 166.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -52.22 -37.79 56.1 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.4 -42.95 67.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -74.39 -54.65 7.17 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.327 0.584 . . . . 0.0 111.626 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.485 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 50.0 t-105 -68.09 -32.59 73.02 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -64.88 -43.5 92.71 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.58 0.705 . . . . 0.0 110.124 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.26 81.83 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.01 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.67 -45.24 81.8 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.076 174.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.4 mttm -58.31 -39.21 78.77 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.011 0.434 . . . . 0.0 110.914 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.16 -30.25 71.33 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.141 0.496 . . . . 0.0 111.614 178.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -88.67 -28.02 20.87 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.817 178.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 88.42 -4.51 85.24 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.992 -170.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.599 ' HG3' HD23 ' A' ' 89' ' ' LEU . 46.1 ttp180 -146.16 141.56 27.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.462 0.305 . . . . 0.0 111.27 -178.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -103.73 141.4 36.15 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.137 0.494 . . . . 0.0 110.546 171.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -73.78 -165.27 0.27 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -85.58 -83.64 1.06 Allowed Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.375 -0.917 . . . . 0.0 111.675 172.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.43 ' H ' HD23 ' A' ' 29' ' ' LEU . 30.0 t 163.96 163.31 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.473 1.109 . . . . 0.0 109.426 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.27 57.38 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.244 0.545 . . . . 0.0 110.642 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.0 t -72.72 -55.08 14.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.291 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -51.95 -46.09 64.61 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.95 0.405 . . . . 0.0 111.97 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.43 HD23 ' H ' ' A' ' 25' ' ' SER . 4.0 mm? -73.18 -25.33 60.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.28 86.15 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.147 0.498 . . . . 0.0 110.932 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -70.39 -39.81 74.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.293 0.568 . . . . 0.0 110.526 170.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.17 -4.51 18.27 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.681 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -165.6 163.05 19.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.824 0.345 . . . . 0.0 110.986 -178.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 58.4 mt -72.9 129.29 36.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.171 0.51 . . . . 0.0 111.399 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -124.14 106.71 10.55 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.121 0.486 . . . . 0.0 111.049 177.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.436 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 72.3 mt -86.54 175.29 8.41 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.173 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.5 p -128.58 153.63 47.03 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.985 0.421 . . . . 0.0 112.067 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.449 ' H ' ' CG ' ' A' ' 41' ' ' GLN . . . -98.36 -174.13 2.75 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.798 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -46.48 -66.12 1.87 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 114.943 0.737 . . . . 0.0 114.943 -173.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.29 -54.99 40.52 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 121.234 0.54 . . . . 0.0 111.926 -176.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' CG ' ' H ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.99 -34.53 76.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.419 -177.21 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.98 -46.59 62.04 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.878 0.37 . . . . 0.0 111.093 177.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.429 ' HG2' ' HB2' ' A' ' 109' ' ' LEU . 8.3 tm0? -61.32 -41.82 97.65 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.2 -53.9 48.64 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 110.664 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.514 HG23 ' CD1' ' A' ' 49' ' ' TRP . 68.6 m -53.09 -38.68 62.78 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 120.934 0.397 . . . . 0.0 111.436 177.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.604 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -60.37 -39.01 85.69 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.58 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -82.08 -24.86 34.98 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.796 178.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.05 -64.79 1.11 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.149 0.5 . . . . 0.0 112.237 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.514 ' CD1' HG23 ' A' ' 45' ' ' THR . 52.9 m95 -91.65 -24.99 19.35 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -172.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.436 ' HA ' ' HG3' ' A' ' 53' ' ' GLN . 62.6 m-85 -108.1 17.6 22.13 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 40.1 ttm180 -73.09 115.6 12.61 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.81 29.67 54.12 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.135 -0.555 . . . . 0.0 114.154 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.436 ' HG3' ' HA ' ' A' ' 50' ' ' PHE . 83.5 mm-40 -88.38 -163.74 1.01 Allowed 'General case' 0 N--CA 1.473 0.716 0 O-C-N 122.446 -0.444 . . . . 0.0 111.586 177.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.32 136.08 31.19 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.526 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 55.25 81.31 0.11 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.0 mt -109.09 119.86 40.82 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.473 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 13' ' ' TRP . 21.5 t -104.99 116.61 49.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 120.831 0.348 . . . . 0.0 111.182 179.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 5' ' ' TYR . 63.4 tp -88.17 111.53 21.72 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.784 0.326 . . . . 0.0 111.18 178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.8 mt -83.45 119.28 24.47 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.802 0.334 . . . . 0.0 110.836 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HB1' HD12 ' A' ' 3' ' ' LEU . . . -116.02 96.25 5.49 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.108 0.48 . . . . 0.0 111.157 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.506 ' O ' HG12 ' A' ' 4' ' ' ILE . 36.5 t -106.08 139.27 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.848 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 2' ' ' THR . 24.5 mt-10 -89.81 127.21 35.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.974 -0.454 . . . . 0.0 110.512 176.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -36.37 -52.33 0.83 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -171.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 68.97 133.82 0.04 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 CA-C-O 120.868 0.366 . . . . 0.0 111.653 176.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.05 53.3 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 122.553 2.169 . . . . 0.0 112.888 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.8 mt -63.09 -23.22 67.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 122.868 0.467 . . . . 0.0 112.201 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 139.48 -88.69 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.325 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -149.81 25.84 0.83 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 122.129 0.966 . . . . 0.0 109.928 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.56 -42.87 98.32 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.544 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 82' ' ' PRO . 17.8 tp -100.25 105.8 17.4 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.049 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -103.56 107.88 18.92 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.901 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 71.7 m95 -73.54 112.53 9.71 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.811 0.338 . . . . 0.0 111.395 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.558 ' HB2' ' CE1' ' A' ' 83' ' ' HIS . 36.5 mt-10 -139.53 134.19 31.86 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.094 0.473 . . . . 0.0 111.065 -178.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.819 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -70.32 96.53 1.14 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 112.035 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m -69.41 -23.87 63.77 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.856 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -118.95 28.34 8.34 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.719 0.295 . . . . 0.0 111.411 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.24 -80.75 0.72 Allowed Glycine 0 CA--C 1.53 0.979 0 C-N-CA 120.974 -0.631 . . . . 0.0 113.393 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.21 -42.92 49.04 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.911 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -85.25 121.6 28.23 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.575 -0.368 . . . . 0.0 111.679 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.819 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 63.3 mtm180 -85.73 149.55 25.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.005 0.431 . . . . 0.0 111.407 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -136.28 126.01 16.03 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.402 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HB2' HD11 ' A' ' 70' ' ' LEU . 49.0 Cg_endo -68.78 111.94 2.75 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 122.4 2.067 . . . . 0.0 112.495 175.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.558 ' CE1' ' HB2' ' A' ' 73' ' ' GLU . 53.5 m170 -91.45 137.36 32.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.857 0.361 . . . . 0.0 111.789 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 56.8 tp -117.17 118.82 33.36 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.844 0.354 . . . . 0.0 110.231 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -96.24 37.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 ptt85 -164.3 155.13 13.31 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.336 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.531 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 18.2 Cg_endo -58.02 148.36 77.42 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.381 2.054 . . . . 0.0 112.92 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.81 103.39 15.95 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.101 0.476 . . . . 0.0 111.862 -172.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.599 HD23 ' HG3' ' A' ' 21' ' ' ARG . 73.8 mt -66.27 141.19 58.11 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.981 176.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.22 -36.21 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.274 0.559 . . . . 0.0 110.413 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.4 m -71.88 -0.23 10.79 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.938 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 4.9 tp10 -97.14 -17.43 19.92 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.202 0.525 . . . . 0.0 110.592 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HA ' HG22 ' A' ' 61' ' ' VAL . 57.3 t -78.53 121.55 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.086 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.446 HG21 ' HG3' ' A' ' 62' ' ' GLU . 12.9 m -67.68 -56.42 9.41 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.826 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -139.8 162.62 34.7 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.064 0.459 . . . . 0.0 111.705 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -150.37 158.64 44.38 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.5 177.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.47 122.37 3.57 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -75.9 104.91 6.66 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.91 0.386 . . . . 0.0 110.998 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.575 HD22 ' O ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -131.42 91.82 3.07 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 122.321 1.057 . . . . 0.0 110.883 177.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -91.13 90.75 7.95 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.832 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.406 HD22 ' O ' ' A' ' 105' ' ' GLY . 54.0 mt 62.65 -170.46 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 173.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -154.73 -164.98 1.94 Allowed 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.4 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.68 -29.81 28.59 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -98.85 4.13 47.46 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.133 -0.354 . . . . 0.0 111.887 -174.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.406 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 78.92 9.31 87.22 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.576 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.7 t -121.92 134.55 24.74 Favored Pre-proline 0 CA--C 1.54 0.581 0 O-C-N 122.596 -0.355 . . . . 0.0 110.809 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.604 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.8 Cg_endo -62.04 100.98 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 121.959 1.773 . . . . 0.0 112.192 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -70.27 78.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.208 0.528 . . . . 0.0 112.346 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.429 ' HB2' ' HG2' ' A' ' 43' ' ' GLN . 9.8 mp -65.45 -18.54 65.39 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 176.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.85 -36.37 41.53 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 121.265 -0.493 . . . . 0.0 113.504 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -79.85 -34.83 39.03 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.999 0.428 . . . . 0.0 111.542 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -83.3 -25.69 31.31 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -172.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 mt -91.45 -64.42 1.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.436 0.636 . . . . 0.0 111.135 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -161.53 124.99 3.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.061 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.7 mt -48.88 94.81 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -171.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.32 174.652 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.677 0.275 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 63' ' ' ALA . 46.5 p -87.2 142.17 28.11 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 111.398 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 62' ' ' GLU . 88.0 mt -127.9 141.64 51.49 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.148 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 63' ' ' ALA . 23.0 pt -110.66 139.31 34.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.897 0.379 . . . . 0.0 111.19 177.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.416 ' HB3' HD11 ' A' ' 58' ' ' LEU . 66.0 m-85 -122.13 136.2 54.88 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.922 0.391 . . . . 0.0 111.631 -175.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.492 ' HD2' ' HG ' ' A' ' 36' ' ' LEU . 57.3 tttp -138.9 113.42 8.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.001 0.429 . . . . 0.0 111.158 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.3 mt -85.31 140.13 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.082 179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.8 pt? -161.07 160.71 30.79 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.68 0.276 . . . . 0.0 110.914 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 t -70.23 151.42 45.37 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.786 0.327 . . . . 0.0 111.173 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.05 -28.35 66.37 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.786 0.327 . . . . 0.0 110.322 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.95 99.11 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.234 175.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -67.73 -46.9 70.85 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.248 0.547 . . . . 0.0 110.715 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 30.6 t-105 -60.27 -49.7 76.56 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.467 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.72 -30.72 71.78 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.46 86.63 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.313 0.577 . . . . 0.0 110.984 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.28 66.86 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.18 0.514 . . . . 0.0 111.371 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HA ' HG11 ' A' ' 90' ' ' VAL . 28.3 ttpp -67.3 -27.43 67.17 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.538 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -46.34 87.96 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.939 0.4 . . . . 0.0 111.272 176.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.437 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 24.4 pt20 -84.14 -19.86 33.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.432 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.2 -0.35 63.9 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 121.365 -0.445 . . . . 0.0 113.623 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 14.1 ptt180 -140.33 138.3 34.8 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.272 0.558 . . . . 0.0 112.141 -177.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -104.22 95.98 6.33 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.319 173.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -85.15 -1.93 57.45 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.219 0.533 . . . . 0.0 110.626 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.47 149.27 9.51 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.86 -0.609 . . . . 0.0 113.178 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.9 m -73.93 -179.56 3.79 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 122.626 -0.338 . . . . 0.0 110.294 173.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -45.91 -47.82 16.24 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.7 t -68.53 -55.57 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -54.74 -51.75 64.66 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.35 -36.76 83.22 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.53 -38.21 77.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.105 0.479 . . . . 0.0 111.472 176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -78.49 -33.63 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.168 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.22 -5.92 84.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 121.241 -0.504 . . . . 0.0 112.207 -175.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HA ' ' A' ' 85' ' ' TYR . 31.6 m-85 -124.49 111.93 16.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.473 0.309 . . . . 0.0 110.506 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 64.8 mt -62.32 113.25 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 120.967 0.413 . . . . 0.0 111.199 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -104.21 123.87 48.1 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 112.076 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 3.8 mp -110.48 166.7 10.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.206 -179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.3 m -111.05 116.5 31.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.864 0.364 . . . . 0.0 110.799 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.72 131.35 34.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -175.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.19 -127.81 42.47 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.041 0.776 . . . . 0.0 115.041 170.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -65.49 -19.21 65.83 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.84 0.352 . . . . 0.0 111.845 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -69.54 -29.02 66.51 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 110.716 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.8 -44.39 81.38 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.124 0.487 . . . . 0.0 110.817 175.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.431 HE21 ' HB2' ' A' ' 109' ' ' LEU . 6.3 tp-100 -61.32 -41.05 96.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.077 175.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 31.7 tt0 -60.7 -49.94 75.49 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.696 0.284 . . . . 0.0 110.624 174.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 58.0 m -57.24 -35.61 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.023 0.44 . . . . 0.0 110.933 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.18 88.16 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.0 174.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.41 -9.96 57.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 116.31 -0.405 . . . . 0.0 112.018 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 44' ' ' GLU . 33.9 mmtp -90.17 -61.18 1.74 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.101 0.477 . . . . 0.0 111.834 177.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -110.16 -40.12 4.8 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -171.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.487 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 99.9 m-85 -96.79 16.94 17.75 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -169.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.6 ptt180 -76.17 141.33 41.89 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.056 0.455 . . . . 0.0 111.8 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 63.14 23.17 65.86 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 114.461 0.545 . . . . 0.0 114.461 175.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.487 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 74.3 mt-30 -98.85 144.61 27.86 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.429 0.615 . . . . 0.0 111.424 177.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -89.28 142.25 27.82 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 60.4 81.31 0.18 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.048 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 97.2 mt -114.36 151.96 32.21 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.15 0.5 . . . . 0.0 111.75 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 49.5 t -130.46 142.81 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.783 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.9 tp -111.39 104.63 13.09 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.944 0.402 . . . . 0.0 110.648 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD22 HG11 ' A' ' 93' ' ' VAL . 84.8 mt -79.9 108.38 13.43 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.913 0.387 . . . . 0.0 111.03 177.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.449 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -108.18 118.02 35.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.889 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.6 t -125.53 143.64 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.106 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.437 ' HA ' HD23 ' A' ' 3' ' ' LEU . 46.6 tt0 -72.53 125.36 27.24 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 110.839 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.547 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -82.01 37.61 0.49 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 -176.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.81 117.23 39.83 Favored Pre-proline 0 CA--C 1.544 0.748 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -46.28 83.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.118 3.212 . . . . 0.0 114.596 -176.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 66' ' ' LEU . 3.9 mp -54.03 -56.26 19.63 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.687 0.755 . . . . 0.0 109.869 171.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.24 -136.71 2.05 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.834 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 37.8 tt0 -93.51 5.87 50.14 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.297 0.57 . . . . 0.0 111.139 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -81.2 -45.76 15.85 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -176.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 tp -81.13 103.07 10.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.989 0.423 . . . . 0.0 110.912 175.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.654 ' HE3' ' HB2' ' A' ' 73' ' ' GLU . 35.9 ttpt -114.01 117.61 31.81 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.827 0.346 . . . . 0.0 111.912 -177.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -71.57 98.17 1.83 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.096 0.474 . . . . 0.0 109.827 170.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.654 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -98.53 129.88 45.1 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.23 84.15 6.06 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.076 0.465 . . . . 0.0 110.021 171.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.5 m -61.08 106.54 0.61 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.772 -176.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.0 ttm180 66.32 -75.51 0.05 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.46 0.704 . . . . 0.0 111.807 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -94.26 -159.11 33.84 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.774 177.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.84 39.76 2.43 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.344 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.434 ' HB1' ' CE2' ' A' ' 81' ' ' PHE . . . -91.08 108.22 19.72 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.56 -0.377 . . . . 0.0 111.413 -177.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -75.58 92.74 2.94 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -176.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.434 ' CE2' ' HB1' ' A' ' 79' ' ' ALA . 65.5 m-85 -117.51 109.45 41.91 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 120.912 0.387 . . . . 0.0 111.91 177.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.628 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 55.2 Cg_endo -68.9 122.43 9.34 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.695 2.263 . . . . 0.0 112.515 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -115.19 120.35 39.44 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.41 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.459 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 16.2 mt -88.62 120.15 29.75 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.059 0.457 . . . . 0.0 111.7 176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.434 ' HA ' ' HD1' ' A' ' 33' ' ' PHE . 4.4 m-85 -82.86 13.36 3.95 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.351 174.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -133.54 145.66 57.26 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.212 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -62.91 134.14 45.03 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.356 2.037 . . . . 0.0 111.845 171.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.3 tp -93.42 107.53 19.35 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.4 135.21 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.217 -0.302 . . . . 0.0 110.482 174.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' A' ' 17' ' ' LYS . 18.9 m -60.53 -30.36 46.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.96 0.409 . . . . 0.0 111.874 -177.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -63.94 -18.02 63.83 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.598 176.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -90.57 -19.84 23.29 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.634 -177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.463 HG11 HD22 ' A' ' 59' ' ' LEU . 58.9 t -61.99 115.73 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 120.647 0.261 . . . . 0.0 110.998 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.449 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 27.9 m -53.36 -45.38 69.14 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -176.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 95' ' ' ARG . 36.8 ttt180 -162.39 146.76 12.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.178 0.513 . . . . 0.0 112.021 174.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -101.78 95.47 6.43 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.535 0.683 . . . . 0.0 110.199 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -77.91 137.74 38.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.761 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -75.66 149.11 38.23 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.471 178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 107' ' ' PRO . 29.5 tp -140.07 133.24 29.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -173.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -123.77 171.12 9.87 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.296 0.57 . . . . 0.0 111.861 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 66.2 mt -106.72 149.55 27.19 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.742 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -96.64 -161.4 0.87 Allowed 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.099 0.476 . . . . 0.0 111.41 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.15 -23.57 67.16 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -94.04 -9.99 34.95 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.139 -0.351 . . . . 0.0 111.544 177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.01 22.01 60.12 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.242 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 59.1 t -100.5 130.27 26.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 O-C-N 122.722 -0.281 . . . . 0.0 111.134 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.688 ' HB3' HD21 ' A' ' 99' ' ' LEU . 45.8 Cg_exo -57.72 104.94 0.18 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.369 2.046 . . . . 0.0 112.212 174.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -75.51 100.18 4.45 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.4 mp -100.09 -19.91 16.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.074 176.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.4 -44.85 28.62 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.245 -176.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -72.0 -30.48 65.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -34.48 72.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 178.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 25.1 mt -72.08 161.05 31.46 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.171 0.51 . . . . 0.0 111.934 -175.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -85.79 -43.38 13.37 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 78.4 mt -77.25 164.71 25.34 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 N--CA 1.469 0.521 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.085 178.048 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.586 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.651 0.263 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.4 t -154.54 169.36 24.0 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 80.7 mt -122.23 134.53 54.7 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.929 -174.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.496 HD12 HD13 ' A' ' 36' ' ' LEU . 18.5 pt -121.63 142.44 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-O 121.02 0.438 . . . . 0.0 111.217 176.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 78.9 m-85 -124.68 145.72 49.52 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.151 0.501 . . . . 0.0 112.263 -175.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 58.6 tttm -135.27 126.94 29.03 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.052 171.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 64.4 mt -93.67 135.62 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.651 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.534 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 pt? -156.47 173.46 16.87 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.627 0.251 . . . . 0.0 110.948 177.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.6 p -77.62 150.74 34.61 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.709 0.29 . . . . 0.0 110.702 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -56.37 -39.36 72.79 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.133 0.492 . . . . 0.0 111.081 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.3 95.92 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 112.073 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.59 -44.37 96.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.147 0.498 . . . . 0.0 110.839 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.444 ' CH2' HG13 ' A' ' 90' ' ' VAL . 26.5 t-105 -63.78 -63.81 1.06 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.248 -177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -29.44 67.65 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.19 -47.51 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.145 0.497 . . . . 0.0 111.095 174.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.9 -30.29 65.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.4 ttmt -56.11 -50.87 69.85 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.321 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -36.01 80.11 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.202 0.525 . . . . 0.0 111.358 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -72.44 -24.53 61.22 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.77 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.63 -11.59 13.34 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.161 -0.542 . . . . 0.0 113.261 -177.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -124.86 144.3 50.38 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.508 -0.407 . . . . 0.0 111.965 -176.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.684 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 63.3 t80 -149.19 111.18 4.6 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.067 0.46 . . . . 0.0 111.205 173.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.84 -4.0 44.5 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 122.181 -0.324 . . . . 0.0 111.84 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.63 -176.99 16.91 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.98 -0.628 . . . . 0.0 113.111 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.406 ' O ' HD23 ' A' ' 29' ' ' LEU . 91.4 p -100.3 178.9 4.63 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 122.759 -0.26 . . . . 0.0 110.356 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.8 -27.79 19.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.137 0.494 . . . . 0.0 111.156 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -68.59 -52.93 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.094 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -58.79 -40.46 84.1 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 25' ' ' SER . 4.5 mm? -65.89 -26.71 67.75 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.476 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.31 -47.07 52.69 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.804 0.335 . . . . 0.0 111.218 175.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -64.74 -34.27 77.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.178 0.514 . . . . 0.0 111.406 174.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 93.57 10.67 58.95 Favored Glycine 0 CA--C 1.521 0.458 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.077 -175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -164.18 147.99 9.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 54.0 mt -64.74 109.09 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.064 0.459 . . . . 0.0 110.482 176.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -74.97 87.67 2.33 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.343 0.592 . . . . 0.0 111.802 -177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.496 HD13 HD12 ' A' ' 4' ' ' ILE . 80.5 mt -84.52 173.46 10.81 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.345 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.459 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 69.0 m -148.69 144.63 27.25 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.947 0.403 . . . . 0.0 111.238 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -74.5 163.13 28.12 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.342 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -45.55 -47.89 12.32 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.385 -0.436 . . . . 0.0 113.799 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.15 -51.79 55.78 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 5.0 mt-30 -74.67 -32.44 62.22 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.981 0.419 . . . . 0.0 111.358 -175.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.45 -49.56 74.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.16 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.495 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.2 tt0 -67.3 -41.07 85.98 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.377 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -58.19 -51.91 67.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.965 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 57.4 m -56.37 -38.83 71.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.315 0.579 . . . . 0.0 110.779 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -67.68 -27.68 67.05 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.688 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.34 -41.12 18.59 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -78.53 -42.26 29.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -105.52 -58.18 1.93 Allowed 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -171.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.519 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 95.5 m-85 -91.11 12.69 19.14 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -170.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -66.51 119.73 12.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.045 0.45 . . . . 0.0 112.19 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.68 -0.49 65.18 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.756 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.506 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 65.7 mt-30 -92.97 116.06 28.7 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 117.158 0.479 . . . . 0.0 111.194 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.34 39.79 1.11 Allowed 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -132.36 17.54 4.45 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.744 0.307 . . . . 0.0 111.195 178.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.426 ' CD1' ' HB3' ' A' ' 50' ' ' PHE . 14.1 mt -94.54 124.54 38.64 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -171.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.422 ' O ' HD23 ' A' ' 8' ' ' LEU . 95.6 t -98.85 130.1 48.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.084 169.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.466 HD22 HD21 ' A' ' 99' ' ' LEU . 54.3 tp -97.87 109.37 22.14 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.852 0.358 . . . . 0.0 110.672 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.9 mt -81.02 104.65 11.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.831 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -94.55 93.81 7.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.155 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.748 HG22 HG13 ' A' ' 93' ' ' VAL . 22.3 t -112.26 138.18 42.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.966 -176.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 39.3 mt-10 -83.77 156.11 22.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.778 0.323 . . . . 0.0 110.304 173.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.08 -11.38 59.8 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.914 0.388 . . . . 0.0 111.222 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 3.8 mm-40 -64.79 -51.42 57.77 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.975 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 89.3 Cg_exo -49.86 -56.13 3.43 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.613 2.209 . . . . 0.0 113.97 177.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.648 HD22 HD11 ' A' ' 84' ' ' LEU . 3.2 pp -81.84 -1.12 46.45 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -175.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.23 -155.5 47.55 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.055 -0.593 . . . . 0.0 113.827 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -94.27 14.11 21.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -66.9 -17.08 64.73 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.062 0.458 . . . . 0.0 111.033 175.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.8 tp -72.46 125.43 27.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.797 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -102.51 121.43 42.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.737 0.303 . . . . 0.0 111.385 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -89.04 131.42 35.21 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -137.3 103.28 5.05 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.166 0.508 . . . . 0.0 111.845 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -82.47 79.34 8.94 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.053 0.454 . . . . 0.0 110.936 175.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.4 m -68.01 -21.07 65.06 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.031 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.6 143.52 50.97 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.659 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -51.74 105.14 0.2 Allowed Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.497 -0.383 . . . . 0.0 113.558 -177.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.83 -30.9 9.37 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.348 -0.454 . . . . 0.0 113.423 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -91.05 99.11 12.2 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.209 0.528 . . . . 0.0 111.674 -177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.499 ' HG2' ' HB2' ' A' ' 74' ' ' ALA . 20.2 mtm180 -91.01 101.26 14.02 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.532 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -90.86 114.81 62.67 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -173.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.84 131.33 12.13 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.528 2.152 . . . . 0.0 112.432 174.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.3 m170 -127.23 129.12 47.17 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.648 HD11 HD22 ' A' ' 66' ' ' LEU . 7.1 mt -106.09 111.57 24.25 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.412 176.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -83.53 10.78 8.21 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.725 0.298 . . . . 0.0 111.637 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 86' ' ' ARG . 10.6 ptm180 -137.77 147.61 57.62 Favored Pre-proline 0 N--CA 1.472 0.638 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -176.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.72 135.16 65.3 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.883 2.389 . . . . 0.0 113.519 -177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.0 tp -94.39 131.75 39.73 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -89.56 136.15 33.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.759 0.314 . . . . 0.0 110.817 177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.537 HG21 ' HA ' ' A' ' 17' ' ' LYS . 95.2 t -57.4 -34.37 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 121.263 0.554 . . . . 0.0 110.83 176.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 59.1 p -67.72 -13.49 62.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.945 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -90.4 -21.42 21.96 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 120.901 0.381 . . . . 0.0 111.396 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.748 HG13 HG22 ' A' ' 61' ' ' VAL . 85.4 t -64.79 145.31 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 72.1 m -85.47 -68.68 0.71 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 74.3 ttt180 -126.17 146.75 49.83 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -110.28 124.78 52.26 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.048 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -139.96 108.19 5.79 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.02 128.96 38.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 120.818 0.342 . . . . 0.0 110.26 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.466 HD21 HD22 ' A' ' 58' ' ' LEU . 86.8 mt -78.19 90.63 4.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -174.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -78.49 99.94 6.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.156 0.503 . . . . 0.0 110.493 170.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.74 150.82 28.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.189 0.519 . . . . 0.0 111.928 -178.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -138.38 171.22 14.7 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.906 -170.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.56 -83.5 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 177.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -90.65 -11.75 38.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.042 0.448 . . . . 0.0 111.267 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.15 26.68 33.16 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.478 -175.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.73 126.21 36.2 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 122.356 0.262 . . . . 0.0 110.908 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -68.16 140.56 49.66 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.406 2.071 . . . . 0.0 112.853 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -84.11 87.77 7.16 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.347 0.594 . . . . 0.0 112.208 -175.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 43' ' ' GLN . 11.1 mp -93.96 -4.53 49.57 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.973 -0.454 . . . . 0.0 112.163 176.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.12 -33.45 74.8 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.611 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 -28.93 61.36 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.324 0.583 . . . . 0.0 111.166 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -72.71 -46.08 55.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.132 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.9 mt -85.25 171.49 11.89 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -78.78 106.73 10.98 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.051 0.453 . . . . 0.0 111.632 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.8 tp -92.01 -40.55 11.03 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.812 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -173.548 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m -87.09 96.19 10.21 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.503 0.556 . . . . 0.0 112.503 -171.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.12 119.3 31.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.679 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HB ' HD13 ' A' ' 36' ' ' LEU . 26.6 pt -93.69 146.45 6.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 110.85 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.525 ' HB3' HD11 ' A' ' 58' ' ' LEU . 89.0 m-85 -126.14 133.67 51.54 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.121 0.486 . . . . 0.0 112.192 -174.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE3' ' CZ ' ' A' ' 22' ' ' PHE . 47.0 tttm -130.5 117.27 19.37 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.907 174.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pp -84.3 139.37 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.901 0.381 . . . . 0.0 111.21 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.504 ' HB3' ' HZ2' ' A' ' 6' ' ' LYS . 2.2 pt? -165.96 156.47 12.93 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.933 0.397 . . . . 0.0 111.682 177.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.9 m -69.83 140.1 53.22 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.613 175.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -49.98 -38.34 36.51 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -51.24 -46.32 62.29 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 176.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -66.9 -43.87 82.27 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.799 0.333 . . . . 0.0 111.177 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.531 ' CH2' HG23 ' A' ' 90' ' ' VAL . 28.1 t-105 -63.08 -53.14 58.33 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -177.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -28.5 69.72 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 122.394 -0.191 . . . . 0.0 111.485 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.68 -52.27 63.95 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.071 0.462 . . . . 0.0 110.777 173.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.97 78.79 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.141 0.496 . . . . 0.0 111.14 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -66.33 -38.03 86.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.11 84.96 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.172 0.51 . . . . 0.0 110.831 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -71.41 -27.95 63.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.428 0.633 . . . . 0.0 110.613 173.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.15 4.58 89.79 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.938 -173.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 89' ' ' LEU . 36.1 ttt180 -154.47 139.29 17.14 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -173.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.52 ' CZ ' ' HE3' ' A' ' 6' ' ' LYS . 83.8 t80 -122.44 140.31 52.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.869 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -154.85 74.34 0.92 Allowed 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.695 0.759 . . . . 0.0 111.763 177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 87.26 117.17 1.14 Allowed Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.844 -0.616 . . . . 0.0 113.458 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.442 ' N ' ' HB2' ' A' ' 28' ' ' ASP . 70.1 m -70.43 -179.94 2.26 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 122.638 -0.331 . . . . 0.0 110.842 175.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -46.22 -49.9 16.54 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.211 0.529 . . . . 0.0 111.794 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.8 t -70.68 -51.74 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HB2' ' N ' ' A' ' 25' ' ' SER . 1.0 OUTLIER -54.83 -53.17 58.77 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 122.839 0.456 . . . . 0.0 112.193 -178.144 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 45.8 tp -62.48 -36.64 83.12 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.949 0.404 . . . . 0.0 111.125 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.69 -18.29 61.03 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.906 0.384 . . . . 0.0 111.888 175.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -90.03 -47.2 7.99 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.878 0.371 . . . . 0.0 111.573 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 150.0 -40.74 0.84 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.217 -0.516 . . . . 0.0 112.825 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -150.56 178.49 9.02 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.706 0.289 . . . . 0.0 111.199 -177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 53.5 mt -85.83 125.04 40.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-O 121.011 0.434 . . . . 0.0 111.549 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -107.65 90.88 3.43 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.375 0.607 . . . . 0.0 111.334 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.625 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 80.9 mt -79.55 170.78 16.06 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.194 0.521 . . . . 0.0 111.805 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -132.23 119.37 20.74 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.63 101.81 8.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.68 -91.85 0.01 OUTLIER Glycine 0 CA--C 1.53 0.993 0 N-CA-C 114.489 0.556 . . . . 0.0 114.489 172.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -45.95 -54.95 7.45 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.025 0.53 . . . . 0.0 111.699 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -63.73 -25.03 68.01 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.732 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.18 -54.6 9.19 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.635 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.566 HE21 ' HB2' ' A' ' 108' ' ' GLN . 52.6 tt0 -67.92 -30.81 70.22 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.684 0.278 . . . . 0.0 111.672 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.25 -46.46 77.04 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.627 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.1 m -60.38 -38.58 84.36 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.063 0.459 . . . . 0.0 110.837 175.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.316 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 51' ' ' ARG . . . -77.23 -25.67 51.86 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.928 0.394 . . . . 0.0 111.567 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -82.42 -70.62 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.164 0.507 . . . . 0.0 112.237 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -88.02 -32.64 18.7 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.521 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 88.0 m-85 -101.13 14.36 32.22 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -175.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 2.4 tmt_? -58.39 101.91 0.1 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.356 0.598 . . . . 0.0 111.429 -177.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.69 21.72 30.55 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.294 176.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.521 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 76.5 mt-30 -90.94 -179.28 5.44 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.425 0.613 . . . . 0.0 111.438 173.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -130.5 160.03 35.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -176.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.429 HD22 ' N ' ' A' ' 55' ' ' ASN . 0.9 OUTLIER 61.98 31.07 18.14 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.287 178.002 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.3 mt -76.85 98.32 4.83 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.453 0.644 . . . . 0.0 111.207 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.462 ' O ' HD23 ' A' ' 8' ' ' LEU . 61.0 t -83.7 125.78 40.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.804 176.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 55.2 tp -94.01 101.62 13.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 174.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 91.5 mt -75.17 109.64 8.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.695 0.283 . . . . 0.0 111.194 178.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.27 114.45 28.74 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.563 176.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 93' ' ' VAL . 43.4 t -126.71 127.99 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.53 90.98 2.25 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.519 0.676 . . . . 0.0 111.16 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.69 42.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.307 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 65.7 158.89 0.13 Allowed Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.579 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.9 76.55 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.902 2.401 . . . . 0.0 112.918 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.4 mt -66.98 -65.23 0.71 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.72 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 145.46 -90.65 0.15 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 120.544 -0.836 . . . . 0.0 114.017 177.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -85.02 -42.57 14.74 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -173.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.456 ' HB2' ' HG2' ' A' ' 86' ' ' ARG . 24.7 p-10 -75.45 -41.97 54.43 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.746 0.307 . . . . 0.0 111.805 -173.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.5 tp -85.96 96.49 9.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.219 0.533 . . . . 0.0 109.83 170.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 25.5 tptp -107.54 101.97 11.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.492 -171.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -78.27 103.3 8.12 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HG3' ' HG3' ' A' ' 71' ' ' LYS . 45.3 mt-10 -119.56 107.33 13.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.939 0.4 . . . . 0.0 111.707 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.632 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -77.16 133.57 38.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.345 175.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.1 m -69.3 173.21 5.97 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -51.39 90.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.543 0.687 . . . . 0.0 112.727 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 15.04 60.74 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.767 0.667 . . . . 0.0 114.767 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 165.66 167.74 26.75 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 119.795 -1.193 . . . . 0.0 114.958 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 61.36 97.04 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.907 0.883 . . . . 0.0 113.332 177.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.632 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 8.7 ptp180 -86.92 103.13 15.01 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.237 0.542 . . . . 0.0 111.199 175.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -90.28 120.6 69.1 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.002 -176.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.625 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 20.3 Cg_exo -66.31 96.99 0.35 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.677 2.251 . . . . 0.0 111.959 173.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -90.53 112.9 24.75 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.952 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.444 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 56.8 tp -104.95 123.36 47.63 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.155 0.502 . . . . 0.0 111.254 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -105.36 30.8 5.37 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.54 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' HB2' ' A' ' 69' ' ' ASP . 16.7 mmt85 -132.17 148.68 70.74 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 122.35 0.26 . . . . 0.0 111.554 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.85 123.25 7.82 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.562 2.175 . . . . 0.0 112.283 174.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 58.5 tp -90.55 108.53 19.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.008 0.432 . . . . 0.0 111.537 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 21' ' ' ARG . 4.1 mm? -69.26 142.34 54.17 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.74 175.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.531 HG23 ' CH2' ' A' ' 13' ' ' TRP . 4.4 p -57.08 -30.98 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 121.438 0.637 . . . . 0.0 110.942 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.2 t -62.92 -28.08 69.81 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.286 178.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 10.0 mm-40 -87.13 -2.81 58.9 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.434 ' HA ' HG22 ' A' ' 61' ' ' VAL . 92.5 t -77.82 128.15 38.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 120.813 0.34 . . . . 0.0 111.412 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.506 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 28.7 m -70.5 -61.33 1.81 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.812 0.339 . . . . 0.0 111.377 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 95' ' ' ARG . 24.0 ttt85 -148.5 145.76 28.06 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.28 0.562 . . . . 0.0 111.924 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -111.2 105.58 14.32 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.874 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -87.67 90.25 8.3 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.941 -0.474 . . . . 0.0 111.837 -178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -71.92 110.09 6.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.896 0.379 . . . . 0.0 111.004 177.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 94.9 mt -130.64 106.05 8.23 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -72.1 139.87 48.6 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 166.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 105' ' ' GLY . 83.7 mt -78.96 160.29 27.3 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -152.51 165.74 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 63.42 -84.95 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.484 0.713 . . . . 0.0 112.028 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -106.07 -22.63 12.83 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.873 0.844 . . . . 0.0 109.619 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.559 ' O ' HD13 ' A' ' 101' ' ' LEU . . . 120.25 15.05 5.22 Favored Glycine 0 CA--C 1.522 0.501 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.296 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.551 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 39.8 t -137.32 75.13 46.69 Favored Pre-proline 0 CA--C 1.547 0.862 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.411 ' HD2' HD22 ' A' ' 101' ' ' LEU . 2.9 Cg_endo -83.56 -73.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.482 2.121 . . . . 0.0 109.413 160.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.566 ' HB2' HE21 ' A' ' 43' ' ' GLN . 75.3 mt-30 56.07 -147.05 0.54 Allowed 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 161.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.478 HD12 ' N ' ' A' ' 109' ' ' LEU . 6.3 mp -64.78 5.65 0.3 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -173.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -51.97 -24.32 13.86 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.645 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -98.69 -28.61 13.45 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 120.993 0.425 . . . . 0.0 111.304 175.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -69.85 -36.77 75.81 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 109' ' ' LEU . 52.8 mt -104.97 166.16 10.57 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.894 0.378 . . . . 0.0 111.719 -175.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 63.83 24.91 13.91 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.277 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.752 ' H ' HD23 ' A' ' 115' ' ' LEU . 1.9 pt? -71.27 75.13 0.72 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.867 0.841 . . . . 0.0 111.853 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 N--CA 1.466 0.33 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.525 175.89 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.876 0.369 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.2 m -87.97 106.3 18.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.879 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.45 116.28 22.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.003 0.43 . . . . 0.0 111.526 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 17.4 pt -105.77 129.23 59.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 121.196 0.522 . . . . 0.0 110.55 173.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.529 ' HB3' HD11 ' A' ' 58' ' ' LEU . 6.6 m-85 -110.75 159.22 17.83 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -168.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.525 ' HZ2' ' HG ' ' A' ' 36' ' ' LEU . 6.8 ttpm? -162.11 136.65 6.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.089 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -96.67 141.2 15.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.166 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -153.64 162.66 41.05 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.649 0.261 . . . . 0.0 110.812 174.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -73.69 149.34 41.97 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 19.5 mmm-85 -53.65 -40.44 65.86 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.319 175.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -23.9 59.95 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.921 0.391 . . . . 0.0 111.831 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -89.32 -48.2 7.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 110.526 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 26.3 t-105 -65.17 -55.59 17.71 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.076 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.58 -33.82 68.57 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.31 98.79 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.053 0.454 . . . . 0.0 110.617 173.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.66 93.85 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.414 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HA ' HG21 ' A' ' 90' ' ' VAL . 52.6 mtmt -63.66 -38.3 90.61 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.514 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.26 -40.99 78.8 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.158 0.504 . . . . 0.0 111.139 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -95.89 1.01 52.73 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.826 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.53 5.03 41.85 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 114.22 0.448 . . . . 0.0 114.22 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HG2' ' CD2' ' A' ' 89' ' ' LEU . 60.4 mtt85 -138.22 130.92 29.48 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.899 -0.765 . . . . 0.0 112.255 -175.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -95.25 111.38 23.24 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 169.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -102.81 -10.96 18.66 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -172.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.08 167.82 42.01 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.15 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.2 p -90.39 172.22 8.9 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 122.335 -0.509 . . . . 0.0 111.464 -177.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.37 -32.77 62.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.286 176.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.7 t -63.09 -45.06 99.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.069 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.502 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 7.7 m-20 -56.29 -51.45 68.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.906 0.384 . . . . 0.0 111.125 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.84 -35.48 80.1 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.997 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -35.36 72.2 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.136 0.494 . . . . 0.0 112.067 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.501 ' HB3' ' CE1' ' A' ' 35' ' ' HIS . 12.2 t70 -84.24 -55.65 4.07 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.397 -178.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.34 60.35 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 121.223 -0.513 . . . . 0.0 112.696 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 80.3 m-85 64.39 -171.91 0.18 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.522 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 65.8 mt -55.55 125.46 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -173.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.502 ' CE1' ' HA ' ' A' ' 28' ' ' ASP . 0.7 OUTLIER -87.68 146.59 25.63 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.823 178.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 5.1 mp -142.17 175.67 9.57 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.511 0.325 . . . . 0.0 110.156 167.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 65.5 m -140.52 159.55 41.94 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.043 0.449 . . . . 0.0 112.167 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.58 -174.35 3.81 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.531 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -51.36 -72.89 0.44 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.503 -0.379 . . . . 0.0 113.994 -177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -65.78 -32.45 73.99 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.027 0.442 . . . . 0.0 110.974 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -63.74 -29.51 70.71 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.41 -178.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.03 -44.21 93.22 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.063 0.458 . . . . 0.0 110.917 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -66.71 -34.76 78.55 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.553 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -56.92 -52.08 66.58 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.101 0.477 . . . . 0.0 110.492 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 29.4 m -57.77 -38.96 76.36 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.017 0.437 . . . . 0.0 110.938 176.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.51 -50.07 68.83 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.882 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.04 -22.25 66.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -99.94 -43.23 6.46 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -109.78 -19.51 13.12 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -170.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.526 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 92.7 m-85 -131.81 28.48 4.54 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 122.021 -0.425 . . . . 0.0 112.041 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -71.62 119.12 15.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.849 0.357 . . . . 0.0 111.882 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.5 61.09 4.32 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-N 116.199 -0.455 . . . . 0.0 113.703 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.559 ' HB2' HD11 ' A' ' 56' ' ' LEU . 49.8 mt-30 -140.98 159.95 41.11 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 111.662 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -118.43 175.2 5.82 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.341 177.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 47.3 m-80 61.26 30.23 19.08 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.166 0.508 . . . . 0.0 111.172 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 53' ' ' GLN . 84.9 mt -92.96 127.23 38.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.39 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.51 122.54 60.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.815 0.34 . . . . 0.0 111.109 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.677 ' HB2' HD21 ' A' ' 99' ' ' LEU . 43.7 tp -88.1 98.09 11.34 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.849 0.357 . . . . 0.0 110.253 174.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 93.9 mt -74.18 107.27 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.823 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.49 100.74 10.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.639 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 95.9 t -109.08 131.62 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.038 0.447 . . . . 0.0 112.155 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -73.55 123.18 23.46 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.779 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.17 -52.2 64.78 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -173.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.544 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 1.8 mp0 -59.98 -48.75 93.92 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.544 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 38.1 Cg_exo -62.95 -16.11 52.01 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.153 1.902 . . . . 0.0 113.716 176.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tt -64.79 -65.83 0.62 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.0 -137.04 5.97 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.659 -0.781 . . . . 0.0 114.058 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -103.68 -21.63 13.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -172.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -78.86 30.49 0.2 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -169.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 82' ' ' PRO . 58.6 tp -112.02 140.41 46.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.024 0.44 . . . . 0.0 111.748 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -150.86 128.12 11.27 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.358 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.577 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 76.6 m95 -76.98 86.05 3.5 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.416 0.626 . . . . 0.0 110.504 175.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -95.2 119.42 33.68 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.468 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.98 64.43 2.46 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.228 0.537 . . . . 0.0 110.89 176.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.9 p -77.74 74.15 4.3 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.07 -175.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.46 HH11 ' HB2' ' A' ' 76' ' ' ARG . 3.1 mtm105 67.32 161.23 0.17 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.31 -63.36 3.97 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.19 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.63 150.09 5.2 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.193 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 68.06 -169.75 0.19 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.857 0.463 . . . . 0.0 111.791 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.577 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 4.4 mpt_? -104.86 122.67 46.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.241 0.543 . . . . 0.0 112.157 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -99.72 110.51 59.16 Favored Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.027 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.553 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 51.9 Cg_exo -55.89 111.43 0.77 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.668 2.245 . . . . 0.0 113.17 175.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -97.03 132.46 42.81 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.031 174.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.522 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 59.1 tp -107.91 111.7 23.94 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.937 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.14 30.04 0.28 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -173.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -160.35 154.13 19.19 Favored Pre-proline 0 N--CA 1.471 0.579 0 O-C-N 122.164 -0.335 . . . . 0.0 111.418 177.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.91 118.39 5.26 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.498 2.132 . . . . 0.0 112.331 174.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.6 tp -72.72 100.61 2.88 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.102 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.441 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 55.1 mt -58.9 130.06 45.16 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.506 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.543 HG21 ' HA ' ' A' ' 17' ' ' LYS . 96.0 t -56.54 -34.42 41.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 110.876 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.8 p -62.51 -26.75 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.88 176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -87.11 -18.49 30.35 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -64.11 116.24 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.981 0.42 . . . . 0.0 111.254 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.639 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 51.0 p -70.99 -46.5 62.17 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -144.67 145.02 31.54 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -135.39 136.59 41.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.079 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -144.29 119.63 10.24 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.45 139.14 53.96 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.896 0.379 . . . . 0.0 110.808 177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.677 HD21 ' HB2' ' A' ' 58' ' ' LEU . 3.5 mm? -89.02 105.9 18.08 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -82.54 90.64 6.79 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 168.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.729 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 70.9 mt -89.37 156.52 18.65 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -171.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -144.2 166.25 25.58 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.724 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 54.75 -86.41 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.498 0.719 . . . . 0.0 112.9 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -97.29 -7.36 32.28 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.441 -174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.729 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 69.63 43.73 66.74 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.609 -175.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.869 ' H ' ' HD2' ' A' ' 107' ' ' PRO . 71.4 t -156.08 -57.85 0.02 OUTLIER Pre-proline 0 N--CA 1.485 1.323 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.869 ' HD2' ' H ' ' A' ' 106' ' ' VAL . 7.4 Cg_endo -40.69 -74.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.358 0 C-N-CA 124.462 3.442 . . . . 0.0 116.074 -164.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.613 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.3 OUTLIER -48.69 71.5 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -172.084 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 107' ' ' PRO . 1.3 tp -102.06 -31.06 10.81 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.777 -0.577 . . . . 0.0 111.842 170.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.21 -47.1 34.42 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.678 0.631 . . . . 0.0 114.678 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.05 -26.76 68.99 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.837 0.351 . . . . 0.0 111.658 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -82.25 -28.59 31.76 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.907 0.384 . . . . 0.0 110.965 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 41.0 mt -72.32 -70.16 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 173.87 -82.13 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.069 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.0 mt 55.4 25.18 7.36 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 . . . . . 0 N--CA 1.475 0.811 0 CA-C-O 121.296 0.57 . . . . 0.0 112.249 179.507 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.75 0.31 . . . . 0.0 111.607 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.7 p -123.92 138.12 54.52 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.281 176.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.497 HD21 ' HB1' ' A' ' 60' ' ' ALA . 2.3 tt -118.11 124.57 48.36 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 -173.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.403 HD12 HD22 ' A' ' 36' ' ' LEU . 28.9 pt -96.58 148.33 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.008 0.433 . . . . 0.0 111.219 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.482 ' HB3' HD11 ' A' ' 58' ' ' LEU . 88.2 m-85 -126.79 103.15 7.37 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -172.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 59' ' ' LEU . 23.2 tptp -89.97 109.5 20.53 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.832 0.348 . . . . 0.0 111.208 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 53.1 mt -88.86 137.01 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.214 175.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.506 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 1.7 pt? -166.11 171.13 12.71 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.992 0.425 . . . . 0.0 112.144 -177.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -80.95 148.12 29.96 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.74 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -58.13 -37.08 73.91 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.6 -21.94 65.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.758 0.313 . . . . 0.0 111.736 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HG2' ' HE1' ' A' ' 22' ' ' PHE . 41.6 tt0 -79.24 -51.71 9.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.532 0.682 . . . . 0.0 109.966 175.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.447 ' HB2' HD11 ' A' ' 8' ' ' LEU . 8.1 t-105 -64.01 -61.58 2.18 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.154 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.488 ' HA ' ' HB3' ' A' ' 17' ' ' LYS . 7.0 m-20 -60.69 -26.35 67.06 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.2 -44.45 83.87 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.127 0.489 . . . . 0.0 110.455 172.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.81 63.25 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.023 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.591 ' HA ' HG21 ' A' ' 90' ' ' VAL . 39.1 ttmt -66.02 -42.88 89.05 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.405 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.94 95.18 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.233 0.539 . . . . 0.0 110.753 173.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.91 -28.46 68.95 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.387 173.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.46 9.58 81.83 Favored Glycine 0 CA--C 1.526 0.75 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.088 -171.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.3 ttt-85 -150.93 112.25 4.38 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 122.609 -0.348 . . . . 0.0 111.673 -173.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.495 ' HB3' ' HB3' ' A' ' 88' ' ' LEU . 69.4 t80 -89.8 109.2 20.21 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.992 0.425 . . . . 0.0 110.688 175.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -93.97 -7.84 41.75 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.123 0.487 . . . . 0.0 111.129 -178.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.88 -177.7 19.39 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.922 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.6 p -104.63 -174.79 2.62 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 122.722 -0.281 . . . . 0.0 110.456 176.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.38 -43.79 61.99 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.98 0.419 . . . . 0.0 111.876 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.6 -40.85 82.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.865 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -60.61 -46.0 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.022 0.439 . . . . 0.0 110.919 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.51 -34.03 77.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.277 175.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.99 -44.02 97.61 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.995 0.426 . . . . 0.0 111.027 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -69.48 -32.54 71.5 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.952 0.406 . . . . 0.0 111.136 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.31 -11.51 51.27 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 121.462 -0.399 . . . . 0.0 112.626 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -153.08 155.09 36.16 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.672 0.389 . . . . 0.0 110.731 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.0 mt -73.23 141.75 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.485 0.659 . . . . 0.0 112.233 -172.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -133.34 100.06 4.72 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.677 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.472 HD12 ' N ' ' A' ' 36' ' ' LEU . 4.8 mp -82.14 -32.74 29.93 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -171.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.2 m 73.22 165.14 0.29 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.885 0.474 . . . . 0.0 111.178 -174.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.37 131.26 20.32 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.08 -104.46 0.07 OUTLIER Glycine 0 CA--C 1.527 0.841 0 N-CA-C 115.184 0.834 . . . . 0.0 115.184 171.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -48.59 -45.32 37.86 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.192 0.597 . . . . 0.0 111.67 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -68.33 -38.52 81.6 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.515 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.82 -47.54 65.8 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.672 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.0 -39.19 94.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.87 -52.29 57.35 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.22 0.533 . . . . 0.0 110.593 177.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 m -58.68 -33.02 69.67 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.176 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.21 -48.55 81.0 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.778 0.323 . . . . 0.0 111.108 175.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.99 -39.67 93.01 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.882 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -71.96 -43.79 64.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.994 0.426 . . . . 0.0 111.95 176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -109.42 -66.05 1.09 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -172.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.441 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 98.8 m-85 -76.23 -8.1 56.31 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -163.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -63.31 2.16 0.42 Allowed 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 -173.412 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -149.07 40.05 0.91 Allowed Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.441 ' NE2' ' HA ' ' A' ' 50' ' ' PHE . 1.6 mp0 -122.67 174.9 6.81 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.18 0.514 . . . . 0.0 111.67 178.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.26 161.49 17.14 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.276 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.3 m120 59.8 36.8 22.12 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.206 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.402 HD12 HD21 ' A' ' 101' ' ' LEU . 89.2 mt -74.56 128.66 36.11 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.166 0.508 . . . . 0.0 111.904 -177.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.2 t -121.86 145.83 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.892 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 5' ' ' TYR . 47.2 tp -114.95 102.25 9.79 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.15 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 6' ' ' LYS . 90.4 mt -84.68 117.46 23.8 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.856 0.36 . . . . 0.0 111.414 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.497 ' HB1' HD21 ' A' ' 3' ' ' LEU . . . -102.88 115.83 31.37 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.116 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 50.2 t -126.08 137.32 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 120.772 0.32 . . . . 0.0 111.657 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -77.83 130.99 37.35 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 120.753 0.311 . . . . 0.0 110.62 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.61 -28.37 28.53 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.584 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 7.0 mp0 -63.82 -46.99 82.1 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -174.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 7.8 Cg_endo -49.04 -66.89 0.12 Allowed 'Trans proline' 0 C--N 1.36 1.174 0 C-N-CA 122.532 2.155 . . . . 0.0 113.796 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.501 ' H ' HD23 ' A' ' 66' ' ' LEU . 2.4 pt? -60.84 -26.97 67.73 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 58.81 -108.67 1.65 Allowed Glycine 0 CA--C 1.533 1.18 0 N-CA-C 115.104 0.802 . . . . 0.0 115.104 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -59.9 -27.74 66.97 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -170.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.44 ' HB3' ' HG2' ' A' ' 86' ' ' ARG . 79.0 m-20 -73.56 -7.16 50.77 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.1 tp -120.34 117.51 27.95 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.71 0.291 . . . . 0.0 110.245 174.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -133.45 134.05 43.08 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.14 0.495 . . . . 0.0 112.162 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -81.24 86.89 6.15 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.668 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -75.39 126.22 30.58 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.92 127.68 33.73 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.988 0.423 . . . . 0.0 111.358 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 87.3 p -74.11 176.64 6.37 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.396 0.617 . . . . 0.0 112.244 -177.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.1 ttt180 -65.87 -30.05 70.59 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.972 176.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.96 14.27 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.779 176.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.55 -49.08 0.53 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.616 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.01 142.28 51.67 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -87.28 150.23 24.02 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.0 0.429 . . . . 0.0 111.728 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -130.48 124.74 21.25 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.268 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.98 99.5 0.4 Allowed 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.514 2.142 . . . . 0.0 112.357 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -98.25 125.13 43.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.447 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 52.1 tp -95.46 113.75 25.44 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.679 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -87.6 22.67 2.17 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.245 0.545 . . . . 0.0 111.824 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.44 ' HG2' ' HB3' ' A' ' 69' ' ' ASP . 31.3 mmt180 -131.97 140.6 38.67 Favored Pre-proline 0 N--CA 1.468 0.44 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.678 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -59.28 118.0 4.82 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 121.921 1.747 . . . . 0.0 110.987 170.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 22' ' ' PHE . 56.4 tp -67.12 87.78 0.16 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.437 0.637 . . . . 0.0 111.578 -172.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.5 mt -60.22 134.18 56.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 176.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.591 HG21 ' HA ' ' A' ' 17' ' ' LYS . 79.3 t -60.09 -31.77 48.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 121.201 0.524 . . . . 0.0 110.695 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.1 m -71.04 -11.94 61.24 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.481 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -96.6 -13.79 22.65 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 120.955 0.407 . . . . 0.0 111.141 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t -76.53 137.14 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.861 -177.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.688 HG22 ' HG3' ' A' ' 95' ' ' ARG . 22.8 m -76.3 -66.3 0.82 Allowed 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.688 ' HG3' HG22 ' A' ' 94' ' ' THR . 62.1 mtt85 -141.92 152.79 43.87 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -120.17 125.35 47.99 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.045 0.45 . . . . 0.0 109.959 171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -118.42 155.73 30.24 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.3 0.571 . . . . 0.0 112.537 -175.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -98.7 96.1 7.69 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 1.8 pt? -79.24 149.19 31.95 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.334 0.588 . . . . 0.0 112.26 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -86.53 174.35 9.0 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.844 -177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.713 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 75.1 mt -133.91 86.51 2.29 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.688 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.669 ' HB3' HE21 ' A' ' 108' ' ' GLN . 24.5 t70 -90.3 166.19 13.46 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -174.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.14 -82.17 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -135.01 26.95 3.57 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.341 0.591 . . . . 0.0 110.44 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.713 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 102.36 22.34 9.87 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.71 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.8 t -98.02 112.65 62.37 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 122.495 -0.415 . . . . 0.0 110.844 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.402 ' HB2' HD13 ' A' ' 109' ' ' LEU . 32.4 Cg_exo -59.39 121.94 10.7 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.674 2.249 . . . . 0.0 112.85 177.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.669 HE21 ' HB3' ' A' ' 102' ' ' ASP . 87.0 mm-40 -74.59 75.82 2.0 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.523 0.677 . . . . 0.0 111.645 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.621 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 6.9 mp -73.23 -16.08 61.41 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.946 177.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.95 -36.48 51.16 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.039 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -71.58 -22.58 61.71 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.969 0.414 . . . . 0.0 111.498 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -90.6 -14.38 32.55 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.496 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 18.2 mt -98.32 -161.15 0.85 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.106 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 113' ' ' LEU . . . 76.82 -49.84 0.56 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.292 0.637 . . . . 0.0 112.101 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.5 tt 73.37 -61.89 0.49 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.44 0.696 . . . . 0.0 111.229 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 179.449 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 111.055 0.02 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.5 t 48.99 -177.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 176.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.2 mt -125.49 144.82 50.37 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.416 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.625 HG21 HD11 ' A' ' 70' ' ' LEU . 17.5 pt -118.71 139.88 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-O 121.158 0.504 . . . . 0.0 111.694 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.429 ' HB3' HD21 ' A' ' 58' ' ' LEU . 20.5 m-85 -124.66 147.46 48.53 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.635 -177.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.612 ' HZ3' ' HE2' ' A' ' 22' ' ' PHE . 87.8 tttt -143.7 119.6 10.62 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.794 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.0 mt -92.22 126.55 44.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 120.908 0.385 . . . . 0.0 110.884 175.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.436 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -143.37 168.19 20.41 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.598 -0.273 . . . . 0.0 110.979 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG3' ' A' ' 12' ' ' GLU . 29.0 t -71.25 145.34 49.65 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.977 0.418 . . . . 0.0 111.61 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 10' ' ' ARG . 25.5 tpt85 -56.84 -31.28 64.6 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.965 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.25 -47.2 74.52 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.356 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 43.4 mt-10 -60.07 -42.19 94.03 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.233 0.54 . . . . 0.0 110.893 177.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.511 ' NE1' ' HE2' ' A' ' 17' ' ' LYS . 20.0 t-105 -70.22 -36.49 74.6 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.582 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -60.26 -52.02 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.611 0.72 . . . . 0.0 110.465 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.72 -36.56 79.15 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.521 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.16 -46.89 88.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.957 0.408 . . . . 0.0 111.259 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HE2' ' NE1' ' A' ' 13' ' ' TRP . 68.3 mttm -56.98 -41.56 78.6 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.632 174.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.9 -45.8 91.38 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.25 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -67.49 -26.44 66.36 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.037 0.446 . . . . 0.0 111.287 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 90' ' ' VAL . . . 87.35 -2.34 86.5 Favored Glycine 0 CA--C 1.525 0.658 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.716 -170.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ptt-85 -160.37 168.6 24.87 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.8 0.334 . . . . 0.0 111.325 -176.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.612 ' HE2' ' HZ3' ' A' ' 6' ' ' LYS . 36.6 t80 -136.12 99.65 4.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.252 0.549 . . . . 0.0 110.111 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -94.44 172.89 7.91 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.091 178.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -74.97 140.25 26.4 Favored Glycine 0 CA--C 1.524 0.633 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.688 -175.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.4 m -81.23 167.27 19.78 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 122.789 -0.242 . . . . 0.0 110.422 174.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.93 -32.65 46.76 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.878 0.37 . . . . 0.0 111.252 176.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.4 t -63.46 -51.31 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.222 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.09 -51.0 63.26 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.1 mt -56.47 -32.38 64.92 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.743 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.27 -44.87 51.05 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.987 0.422 . . . . 0.0 111.59 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.97 -34.27 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.19 0.519 . . . . 0.0 111.21 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 138.9 52.59 0.05 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.929 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 65.46 -168.2 0.21 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 122.917 0.487 . . . . 0.0 111.491 -175.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.5 mt -54.26 104.42 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-O 121.234 0.54 . . . . 0.0 112.117 -173.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -77.58 115.46 17.36 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.367 0.603 . . . . 0.0 111.757 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.518 ' HB2' ' HG2' ' A' ' 82' ' ' PRO . 65.1 mt -101.72 -170.27 1.8 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.814 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.8 p -141.31 156.2 45.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -94.63 -177.64 4.28 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.155 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.4 -78.77 0.1 OUTLIER Glycine 0 CA--C 1.53 1.03 0 N-CA-C 114.028 0.371 . . . . 0.0 114.028 -176.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -63.53 -28.48 69.97 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.202 -0.587 . . . . 0.0 111.651 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.87 -38.75 89.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.586 0.231 . . . . 0.0 111.562 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.25 -48.31 82.28 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.732 0.301 . . . . 0.0 110.948 175.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 17.7 tp60 -59.55 -51.3 70.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.726 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.683 ' HG3' ' HE2' ' A' ' 48' ' ' LYS . 11.7 tp10 -62.58 -52.23 64.2 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.216 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 49.8 m -58.62 -38.07 77.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.878 0.37 . . . . 0.0 111.073 177.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -61.73 -44.61 96.59 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.823 0.344 . . . . 0.0 111.334 176.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.94 -25.6 64.64 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.683 ' HE2' ' HG3' ' A' ' 44' ' ' GLU . 54.5 mttm -88.44 -51.88 5.48 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -105.48 -43.02 5.06 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -169.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.511 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 97.1 m-85 -85.06 -2.07 57.57 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -174.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.8 ptt85 -62.36 130.96 47.63 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.087 0.47 . . . . 0.0 111.58 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.39 -7.83 80.53 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.267 -0.492 . . . . 0.0 113.457 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.442 ' HB2' HD11 ' A' ' 56' ' ' LEU . 70.4 mt-30 -91.36 116.75 29.09 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.229 -0.571 . . . . 0.0 111.022 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.66 155.76 19.41 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.897 0.38 . . . . 0.0 111.391 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 63.37 73.0 0.46 Allowed 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.47 0.652 . . . . 0.0 111.435 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 53' ' ' GLN . 97.1 mt -120.76 154.3 35.85 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.804 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.1 t -128.78 138.74 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.939 0.4 . . . . 0.0 111.257 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.429 HD21 ' HB3' ' A' ' 5' ' ' TYR . 5.9 tt -112.95 108.69 17.71 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.973 0.416 . . . . 0.0 109.941 176.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.15 110.98 17.17 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.205 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.444 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -103.83 117.38 34.22 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.78 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.51 130.88 72.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 120.96 0.409 . . . . 0.0 111.667 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -81.17 108.52 14.89 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.053 0.454 . . . . 0.0 110.848 176.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.83 52.94 2.61 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -169.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.526 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 44.5 mt-10 -80.92 -58.32 0.53 Allowed Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 121.914 -0.491 . . . . 0.0 111.975 176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 83.1 Cg_endo -76.68 -38.72 0.86 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 122.07 1.847 . . . . 0.0 113.338 -178.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.586 ' H ' HD23 ' A' ' 66' ' ' LEU . 2.5 pt? -98.57 21.66 10.95 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.185 0.517 . . . . 0.0 111.561 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.52 -11.14 40.11 Favored Glycine 0 CA--C 1.531 1.057 0 N-CA-C 115.0 0.76 . . . . 0.0 115.0 -174.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -121.5 4.69 10.16 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 117.753 0.777 . . . . 0.0 111.49 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.589 ' HB3' ' HD3' ' A' ' 86' ' ' ARG . 2.3 m-20 -80.45 -1.94 43.67 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.372 0.606 . . . . 0.0 111.008 175.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.625 HD11 HG21 ' A' ' 4' ' ' ILE . 2.7 pt? -137.07 163.83 29.85 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.026 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -123.79 126.22 46.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.997 0.427 . . . . 0.0 111.92 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -80.29 82.73 6.28 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.174 0.512 . . . . 0.0 110.315 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -77.94 98.24 5.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.328 0.585 . . . . 0.0 112.178 -175.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -92.16 67.72 5.05 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.546 0.689 . . . . 0.0 110.006 172.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 79.8 p -129.37 -73.13 0.57 Allowed 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.612 -176.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 -70.27 102.38 2.11 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.773 0.32 . . . . 0.0 111.191 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.91 -19.4 41.16 Favored Glycine 0 CA--C 1.525 0.698 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.046 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.65 -33.74 4.85 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 121.279 -0.486 . . . . 0.0 113.987 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . -77.72 169.46 18.26 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.113 0.483 . . . . 0.0 112.015 -178.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -83.28 110.19 17.89 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.47 -178.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -115.26 105.71 52.12 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.518 ' HG2' ' HB2' ' A' ' 36' ' ' LEU . 44.7 Cg_endo -71.76 114.26 3.9 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.564 2.176 . . . . 0.0 112.694 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -108.74 118.6 37.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.879 175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.413 HD22 ' H ' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -90.94 116.07 28.46 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.069 0.462 . . . . 0.0 110.43 178.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -87.14 9.32 20.31 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.023 0.44 . . . . 0.0 111.771 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 69' ' ' ASP . 35.1 mtp85 -129.52 149.41 72.79 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.065 -176.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.62 132.14 28.04 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 122.635 2.224 . . . . 0.0 112.701 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 93' ' ' VAL . 10.1 tt -89.6 106.32 18.38 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.9 mt -74.46 138.55 43.31 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.256 -0.277 . . . . 0.0 110.369 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 20' ' ' GLY . 26.2 m -61.19 -31.46 50.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.862 -0.524 . . . . 0.0 111.763 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 84.9 p -67.47 -12.28 59.92 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.67 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -90.65 -21.57 21.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.578 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 88' ' ' LEU . 48.7 t -62.21 118.15 4.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.694 0.283 . . . . 0.0 111.687 -176.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 87.8 m -58.45 -56.38 22.9 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 121.017 0.437 . . . . 0.0 111.125 177.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -145.0 144.63 31.13 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.219 0.533 . . . . 0.0 111.483 175.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -116.5 103.53 10.51 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.39 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -91.03 107.39 19.17 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.761 0.315 . . . . 0.0 111.827 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.65 111.35 4.74 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.08 119.33 9.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.471 0.653 . . . . 0.0 112.43 -173.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -71.73 -42.17 67.62 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.614 -176.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.4 mt 68.27 132.79 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.246 0.618 . . . . 0.0 111.836 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -140.09 162.29 35.59 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.272 0.558 . . . . 0.0 111.896 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.19 -79.82 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.507 0.929 . . . . 0.0 113.507 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -105.21 11.97 32.44 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -171.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 71.89 30.08 66.3 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.026 -173.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.78 142.3 26.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.123 0.569 . . . . 0.0 109.999 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.441 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 13.0 Cg_exo -71.99 103.72 1.53 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 122.13 1.887 . . . . 0.0 112.68 173.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -80.88 80.83 7.28 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.16 0.505 . . . . 0.0 111.643 178.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.9 mp -66.11 -26.67 67.56 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 122.048 -0.408 . . . . 0.0 110.864 174.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -57.28 -23.05 46.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.338 -0.458 . . . . 0.0 113.333 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -98.76 -11.73 21.61 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 122.463 -0.433 . . . . 0.0 111.584 175.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -88.8 -37.95 15.02 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.808 0.337 . . . . 0.0 111.502 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 14.0 mt -86.89 -172.15 3.85 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.301 -175.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.05 71.93 1.63 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.852 0.358 . . . . 0.0 111.854 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.1 mt 57.1 -88.31 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.179 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 121.312 0.577 . . . . 0.0 112.216 177.5 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p -96.13 145.83 25.17 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.97 123.54 46.06 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.864 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.619 HD12 HD13 ' A' ' 36' ' ' LEU . 13.1 pt -108.71 153.75 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -177.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 94.9 m-85 -131.85 163.11 28.99 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.583 0.706 . . . . 0.0 112.536 -176.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HZ3' HD23 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -157.95 115.56 3.0 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 177.198 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.5 mt -102.38 127.43 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 120.613 0.244 . . . . 0.0 111.339 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.444 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -151.92 166.0 32.84 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.916 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 m -69.46 146.71 51.74 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 122.3 -0.25 . . . . 0.0 111.67 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -57.25 -52.2 66.3 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -53.46 -39.76 64.73 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.162 0.506 . . . . 0.0 111.409 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -67.11 -36.33 81.69 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.847 177.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -64.28 -48.49 75.48 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.221 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.28 -30.22 69.32 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 120.53 0.205 . . . . 0.0 111.375 176.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.05 -60.19 3.78 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.989 0.423 . . . . 0.0 110.882 174.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.21 -35.22 69.37 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 111.266 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.622 ' HA ' HG21 ' A' ' 90' ' ' VAL . 26.5 ttpp -69.92 -31.87 69.87 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.395 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.87 -21.7 61.62 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.303 0.573 . . . . 0.0 111.037 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -87.74 -23.13 24.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.971 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.95 -2.74 63.64 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 121.275 -0.488 . . . . 0.0 112.117 -172.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.568 ' HG3' HD23 ' A' ' 89' ' ' LEU . 54.0 ttp180 -143.13 141.53 31.23 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.006 0.431 . . . . 0.0 111.663 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -110.16 109.67 20.27 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.627 176.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -122.56 90.33 3.28 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.615 0.721 . . . . 0.0 112.226 179.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA2' ' HB2' ' A' ' 28' ' ' ASP . . . 65.98 101.62 0.02 OUTLIER Glycine 0 CA--C 1.533 1.194 0 N-CA-C 115.671 1.028 . . . . 0.0 115.671 171.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 63.2 m -76.75 177.9 7.22 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 167.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.06 -46.45 33.5 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.112 0.482 . . . . 0.0 112.294 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 31.0 t -70.06 -44.59 78.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.739 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HB2' ' HA2' ' A' ' 24' ' ' GLY . 5.2 m-20 -64.35 -27.5 69.06 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.87 0.367 . . . . 0.0 111.481 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.48 -36.3 73.77 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.04 0.448 . . . . 0.0 110.312 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.16 -49.0 77.6 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.741 172.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -62.04 -28.17 69.4 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.623 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.82 -45.96 3.09 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -175.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -116.68 145.26 43.56 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -52.8 114.67 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -176.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -90.45 107.96 19.48 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.813 0.816 . . . . 0.0 110.532 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.684 HD23 ' HZ3' ' A' ' 6' ' ' LYS . 35.0 mt -89.45 54.88 3.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.522 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.8 m -45.87 107.12 0.09 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.897 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -103.31 147.05 27.56 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.6 -113.43 3.08 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-N 115.541 -0.754 . . . . 0.0 114.667 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -54.89 -47.67 74.02 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -59.81 -39.97 86.84 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.757 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.36 -56.55 19.09 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.939 0.399 . . . . 0.0 111.445 178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -61.74 -49.7 75.36 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.8 -22.38 66.98 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -176.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 99.0 m -81.0 -40.5 24.22 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.21 0.529 . . . . 0.0 110.311 171.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.57 74.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.278 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.58 -24.57 67.62 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -100.31 -56.54 2.33 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.129 0.49 . . . . 0.0 111.971 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 45.0 m95 -78.6 -37.72 41.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -109.25 8.85 25.9 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -172.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.25 136.62 58.11 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.979 0.419 . . . . 0.0 111.654 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.66 -26.02 16.14 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.404 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -85.82 116.23 23.95 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 122.534 -0.392 . . . . 0.0 111.424 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB1' ' HA ' ' A' ' 100' ' ' ASP . . . -103.89 -0.46 29.05 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -92.03 15.78 12.59 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.65 159.08 18.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -177.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.7 143.34 38.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.988 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.0 tt -98.68 133.57 42.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.796 0.331 . . . . 0.0 110.967 175.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.4 mt -104.94 130.01 53.21 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.322 0.249 . . . . 0.0 110.975 177.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -118.84 122.19 41.78 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.721 0.296 . . . . 0.0 110.915 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.2 t -133.84 137.88 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.735 0.302 . . . . 0.0 111.562 -176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -77.19 127.65 32.99 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 170.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -52.36 64.12 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -175.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.481 ' HG3' ' HD2' ' A' ' 65' ' ' PRO . 35.0 tt0 69.43 141.52 0.08 OUTLIER Pre-proline 0 N--CA 1.477 0.921 0 C-N-CA 122.885 0.474 . . . . 0.0 110.874 -173.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 24.4 Cg_endo -61.59 77.45 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 122.575 2.184 . . . . 0.0 112.65 177.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.4 mt -72.64 -59.38 2.75 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.661 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 168.78 -118.71 0.79 Allowed Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.365 -178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -130.38 18.26 5.36 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 122.381 -0.482 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -79.37 -36.6 39.04 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.83 0.348 . . . . 0.0 111.554 177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 tp -81.55 101.82 10.21 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.254 0.549 . . . . 0.0 110.804 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HD3' ' CE1' ' A' ' 85' ' ' TYR . 48.9 mtpt -95.67 109.87 22.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.136 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.535 ' CZ3' ' HG3' ' A' ' 82' ' ' PRO . 78.1 m95 -74.25 73.38 1.8 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.717 0.77 . . . . 0.0 109.256 167.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -90.15 117.5 28.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.003 -0.998 . . . . 0.0 112.246 -169.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 79' ' ' ALA . . . -86.71 132.8 33.77 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 176.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.2 t -145.52 178.89 7.79 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 62.97 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.903 0.481 . . . . 0.0 111.7 -178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.32 23.65 0.44 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.38 -158.64 26.98 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.982 -0.447 . . . . 0.0 111.982 -176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 74' ' ' ALA . . . 62.87 111.42 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.253 0.549 . . . . 0.0 112.371 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 -82.16 93.4 7.05 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.938 0.399 . . . . 0.0 111.63 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -78.86 113.98 39.99 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.515 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 12.3 Cg_exo -69.61 88.31 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.464 2.109 . . . . 0.0 112.494 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -88.52 106.49 18.32 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.5 tp -92.05 122.65 34.75 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.05 0.453 . . . . 0.0 111.229 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 71' ' ' LYS . 2.0 m-85 -86.43 21.18 2.18 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.471 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 12.1 mtm180 -132.6 143.15 47.55 Favored Pre-proline 0 N--CA 1.473 0.709 0 O-C-N 122.048 -0.408 . . . . 0.0 111.278 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.41 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . 21.9 Cg_exo -65.87 111.12 1.85 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.299 1.999 . . . . 0.0 111.447 172.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.45 114.12 10.23 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.887 0.375 . . . . 0.0 110.802 -170.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.568 HD23 ' HG3' ' A' ' 21' ' ' ARG . 71.0 mt -73.26 142.28 47.24 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.745 0.307 . . . . 0.0 111.155 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.622 HG21 ' HA ' ' A' ' 17' ' ' LYS . 86.1 t -59.08 -31.39 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 121.304 0.573 . . . . 0.0 111.06 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 57.6 p -73.79 -10.83 60.08 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.17 176.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 89' ' ' LEU . 55.3 mt-10 -89.22 -18.31 27.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.852 0.358 . . . . 0.0 110.556 172.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.1 t -72.52 127.45 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.409 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 89.0 m -73.33 -65.22 0.84 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 34.1 ptt-85 -148.18 154.56 40.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.812 0.339 . . . . 0.0 111.767 -174.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -105.62 174.19 5.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.043 0.449 . . . . 0.0 110.768 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HB1' ' CE1' ' A' ' 112' ' ' HIS . . . -152.72 98.17 2.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.808 0.337 . . . . 0.0 111.601 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.08 136.56 39.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.511 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.506 HD23 ' N ' ' A' ' 99' ' ' LEU . 1.5 pt? -141.06 97.52 3.19 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.635 0.731 . . . . 0.0 112.172 -177.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.439 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 15.0 t70 -84.64 127.93 34.34 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.498 173.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -155.28 -171.54 3.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.05 0.452 . . . . 0.0 111.932 -171.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -142.48 -168.07 2.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.755 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.18 -0.73 15.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -175.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -133.56 -31.79 1.18 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -54.25 -53.41 37.9 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 110.531 -1.027 . . . . 0.0 110.531 164.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' HD2' ' A' ' 107' ' ' PRO . 2.1 t 65.68 146.04 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.044 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 170.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.553 ' HD2' HG13 ' A' ' 106' ' ' VAL . 24.1 Cg_exo -33.31 99.37 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.25 0 C-N-CA 123.756 2.97 . . . . 0.0 114.613 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -76.26 78.66 3.04 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.609 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.5 mp -100.19 -16.89 17.62 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -55.3 -27.96 48.65 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.246 -0.502 . . . . 0.0 113.921 -176.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -94.95 -9.79 33.01 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . 0.419 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 82.3 m-70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 23.2 mt -81.66 158.41 24.3 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.017 0.437 . . . . 0.0 111.38 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -96.63 15.28 22.16 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.507 HD13 ' HB3' ' A' ' 113' ' ' LEU . 7.2 mp -80.16 97.93 7.1 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.066 0.46 . . . . 0.0 112.022 -176.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 . . . . . 0 N--CA 1.468 0.435 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.576 173.776 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.418 ' O ' ' HB ' ' A' ' 2' ' ' THR . 63.1 mtt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 120.435 0.16 . . . . 0.0 111.138 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.418 ' HB ' ' O ' ' A' ' 1' ' ' MET . 14.5 t 174.86 -169.91 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.558 0.343 . . . . 0.0 111.136 -179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 89.2 mt -115.64 122.54 45.91 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.878 0.37 . . . . 0.0 110.817 177.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 36' ' ' LEU . 23.6 pt -102.51 149.38 7.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.033 0.444 . . . . 0.0 111.458 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.443 ' HB3' HD11 ' A' ' 58' ' ' LEU . 80.3 m-85 -142.65 121.67 12.85 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.772 -174.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HD2' HD23 ' A' ' 36' ' ' LEU . 79.6 tttt -110.48 125.29 53.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.921 0.391 . . . . 0.0 110.896 176.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.461 HD11 HD21 ' A' ' 109' ' ' LEU . 65.9 mt -98.29 132.49 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.342 179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.439 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.2 pt? -145.78 171.06 15.33 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.687 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.4 p -77.85 148.92 34.43 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.127 0.489 . . . . 0.0 111.324 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -56.72 -36.1 69.31 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.5 -49.03 75.9 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.3 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -70.0 -40.85 75.03 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 178.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.505 ' HZ2' ' HG2' ' A' ' 96' ' ' GLU . 41.3 t-105 -63.4 -40.01 96.06 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.509 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 4.7 t0 -62.93 -43.84 97.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.246 0.546 . . . . 0.0 110.039 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.08 -46.08 85.86 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.513 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.62 89.49 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.208 0.527 . . . . 0.0 111.07 175.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.509 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 25.5 ttpp -60.75 -44.14 97.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.984 175.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -38.4 89.89 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.196 0.522 . . . . 0.0 111.352 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.39 -29.13 61.41 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.442 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.1 5.05 89.11 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.736 -170.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.418 HH21 ' CD ' ' A' ' 23' ' ' GLU . 57.2 mtp180 -146.28 134.9 22.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.791 0.436 . . . . 0.0 111.278 -175.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -102.11 98.44 8.61 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.449 0.643 . . . . 0.0 110.008 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.418 ' CD ' HH21 ' A' ' 21' ' ' ARG . 34.8 mm-40 -80.49 -176.05 5.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.23 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -66.12 116.81 8.86 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.176 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 87.4 p -74.21 -174.17 1.87 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.498 -0.413 . . . . 0.0 110.681 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.74 -37.21 65.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.01 0.433 . . . . 0.0 111.12 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 56.3 t -77.94 -47.22 25.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.11 0.481 . . . . 0.0 111.705 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -61.65 -43.1 99.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.174 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.63 -28.63 62.87 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.12 -48.88 73.03 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.046 0.45 . . . . 0.0 110.909 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.51 -31.11 53.28 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.375 173.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.16 -12.45 48.59 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.365 -0.379 . . . . 0.0 112.531 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -141.55 151.51 43.28 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.997 0.519 . . . . 0.0 111.01 -178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.416 HG23 ' NZ ' ' A' ' 6' ' ' LYS . 55.1 mt -69.85 135.27 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -171.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -87.2 145.95 26.2 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.899 173.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.613 HD11 HD12 ' A' ' 84' ' ' LEU . 78.5 mt -134.64 -69.76 0.51 Allowed 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.552 ' OG ' ' HB2' ' A' ' 41' ' ' GLN . 39.9 t 76.89 165.25 0.25 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.484 0.714 . . . . 0.0 112.343 -175.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' ILE . . . -111.05 176.63 4.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.532 176.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -44.27 -44.19 7.68 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 114.441 0.536 . . . . 0.0 114.441 -177.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.06 -66.27 0.41 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.008 0.432 . . . . 0.0 111.929 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.552 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 20.8 mt-30 -76.11 -15.61 60.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -176.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -51.96 64.88 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.777 0.322 . . . . 0.0 110.686 172.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.568 ' HB2' ' HB2' ' A' ' 109' ' ' LEU . 13.3 tt0 -66.74 -35.73 80.8 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.217 175.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.646 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 63.7 mm-40 -55.21 -60.94 2.69 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.998 0.428 . . . . 0.0 110.724 173.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -54.71 -40.13 68.91 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.449 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -61.71 -41.04 97.08 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.466 176.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.85 -37.56 64.76 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.646 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 48.8 mttm -78.98 -61.52 1.99 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.02 0.438 . . . . 0.0 111.9 -178.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.55 -40.67 16.04 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -107.57 35.39 3.1 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 122.303 -0.248 . . . . 0.0 111.617 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.5 mtt180 -24.01 -51.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.711 1.204 . . . . 0.0 113.955 -174.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -155.53 50.14 0.46 Allowed Glycine 0 CA--C 1.525 0.695 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.731 177.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.564 ' HB2' HD21 ' A' ' 56' ' ' LEU . 77.6 mm-40 -77.46 124.74 28.3 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 122.544 -0.386 . . . . 0.0 111.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.46 68.25 4.85 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.128 0.489 . . . . 0.0 112.095 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -175.39 22.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.303 175.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 53' ' ' GLN . 42.1 mt -84.21 141.02 31.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.396 0.617 . . . . 0.0 112.288 -173.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.1 t -123.47 128.59 74.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.381 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.443 HD11 ' HB3' ' A' ' 5' ' ' TYR . 52.7 tp -95.82 114.03 25.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.299 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 77.2 mt -91.56 105.8 18.01 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.805 0.336 . . . . 0.0 110.96 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.69 112.73 24.66 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.479 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 93' ' ' VAL . 20.7 t -130.59 137.36 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.949 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.83 133.74 39.26 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 173.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -53.37 -74.09 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 59.18 161.52 0.09 OUTLIER Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -59.73 -62.13 0.18 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.119 1.879 . . . . 0.0 112.182 169.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.3 pp 34.61 33.71 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 104.98 121.42 4.91 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.849 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.83 -1.12 0.56 Allowed 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 -61.02 -25.43 66.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.761 0.315 . . . . 0.0 111.329 174.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.79 106.14 16.81 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.911 0.386 . . . . 0.0 110.295 174.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 73' ' ' GLU . 78.3 tttt -125.86 128.39 47.55 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -174.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 75.0 m95 -79.38 105.6 10.81 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 122.213 -0.304 . . . . 0.0 111.238 177.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG2' ' HE2' ' A' ' 71' ' ' LYS . 44.3 mt-10 -118.46 131.08 56.27 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 111.784 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.457 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -94.26 115.68 27.96 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.2 t -75.89 173.61 10.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.24 0.543 . . . . 0.0 112.168 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -64.94 98.03 0.26 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.476 0.655 . . . . 0.0 111.599 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 147.49 -33.13 1.33 Allowed Glycine 0 CA--C 1.525 0.657 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.134 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.23 -28.23 3.67 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.45 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -57.73 123.98 17.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.457 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 68.4 mtm180 -97.6 96.85 8.57 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.279 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 68.3 m-85 -104.95 112.81 65.26 Favored Pre-proline 0 CA--C 1.539 0.53 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HA ' ' HA ' ' A' ' 72' ' ' TRP . 27.9 Cg_endo -64.16 108.3 0.94 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 122.079 1.853 . . . . 0.0 111.748 173.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -90.47 126.15 35.81 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.348 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -96.45 112.69 24.34 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.419 178.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -78.69 3.29 16.87 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 120.794 0.331 . . . . 0.0 111.616 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.431 ' HB3' HD22 ' A' ' 84' ' ' LEU . 7.1 tpp180 -119.29 140.1 28.54 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 122.929 0.492 . . . . 0.0 110.635 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -53.19 139.08 63.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.45 2.1 . . . . 0.0 112.484 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.407 HD12 HD21 ' A' ' 36' ' ' LEU . 6.0 tt -88.81 107.11 18.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.188 0.518 . . . . 0.0 111.049 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.547 ' HB2' ' HG2' ' A' ' 92' ' ' GLU . 50.8 mt -79.35 130.79 35.78 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 177.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.2 m -63.54 -22.88 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 O-C-N 121.845 -0.534 . . . . 0.0 111.808 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 58.6 m -66.97 -15.97 64.05 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.532 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.547 ' HG2' ' HB2' ' A' ' 89' ' ' LEU . 51.4 mm-40 -81.51 -18.32 45.51 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.546 ' HA ' HG22 ' A' ' 61' ' ' VAL . 59.6 t -70.87 117.96 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 120.961 0.41 . . . . 0.0 111.879 -176.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.5 m -60.8 -46.95 88.5 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.966 0.413 . . . . 0.0 111.33 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -159.19 148.52 18.57 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.748 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.505 ' HG2' ' HZ2' ' A' ' 13' ' ' TRP . 0.4 OUTLIER -134.02 154.84 50.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.657 0.265 . . . . 0.0 111.14 177.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -166.82 150.05 6.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 120.878 0.37 . . . . 0.0 111.737 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -66.27 123.73 20.75 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.552 HD21 HD11 ' A' ' 109' ' ' LEU . 54.2 tp -78.31 128.55 33.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.585 -174.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -92.26 156.34 17.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.971 0.415 . . . . 0.0 111.306 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 73.7 mt -100.31 174.69 6.01 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.241 0.543 . . . . 0.0 112.016 -175.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.481 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 31.4 t70 -100.95 173.27 6.56 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.346 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.07 -33.16 37.97 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.948 0.404 . . . . 0.0 111.601 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -85.83 -28.98 24.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.254 0.549 . . . . 0.0 110.633 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.04 -23.78 6.46 Favored Glycine 0 CA--C 1.525 0.718 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.605 -174.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 47.3 t -59.24 119.21 36.93 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.448 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 33.9 Cg_exo -59.19 111.32 0.88 Allowed 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 122.538 2.159 . . . . 0.0 112.817 177.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.481 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 85.2 mm-40 -88.79 84.86 6.68 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.299 0.571 . . . . 0.0 112.355 -175.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 43' ' ' GLN . 7.5 mp -81.94 -35.64 28.86 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.495 177.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.76 -34.73 29.62 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 121.043 -0.599 . . . . 0.0 112.949 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.47 -33.38 21.87 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.876 0.369 . . . . 0.0 111.415 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.65 -27.13 65.72 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 48.9 mt -94.03 179.71 5.24 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.196 0.522 . . . . 0.0 112.108 -175.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -78.57 71.15 5.02 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.988 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 41.3 tp -80.5 78.8 7.19 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.26 0.552 . . . . 0.0 110.631 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 121.272 0.558 . . . . 0.0 111.561 179.172 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 120.812 0.339 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 61.6 m -75.72 87.5 2.77 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.099 0.476 . . . . 0.0 111.14 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.0 mt -76.75 111.83 12.69 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.9 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 36' ' ' LEU . 6.9 pt -96.32 135.14 31.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.08 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 71.7 m-85 -116.09 155.96 27.24 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -172.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.483 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 63.0 tttp -154.82 129.65 9.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.627 174.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.55 120.62 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 120.605 0.241 . . . . 0.0 110.931 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.499 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -135.49 158.48 44.26 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.838 0.351 . . . . 0.0 111.237 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 p -69.92 151.36 45.73 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.211 0.529 . . . . 0.0 112.088 -178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 tpp85 -58.81 -60.69 3.44 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.54 -33.79 64.12 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -69.41 -38.82 78.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.897 0.379 . . . . 0.0 111.088 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 44.1 t-105 -64.67 -46.48 82.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.812 0.339 . . . . 0.0 110.77 174.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.6 -37.06 84.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 176.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.528 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -61.76 -53.63 53.43 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.968 0.413 . . . . 0.0 110.828 175.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.32 -37.64 78.28 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.162 0.506 . . . . 0.0 111.311 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.532 ' HA ' HG21 ' A' ' 90' ' ' VAL . 25.7 ttpp -67.42 -33.74 75.8 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.05 177.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.04 -36.43 79.91 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.267 0.556 . . . . 0.0 110.676 173.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 76.2 mm-40 -74.36 -29.45 61.57 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.0 175.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 89.79 2.97 74.62 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 115.993 -0.548 . . . . 0.0 112.587 -175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -154.19 129.0 9.41 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 111.62 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.483 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 65.1 t80 -95.92 97.9 9.99 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.172 0.51 . . . . 0.0 110.204 173.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -71.25 -36.67 71.85 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.132 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.44 157.7 7.66 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.533 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -84.47 170.05 13.89 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.396 0.279 . . . . 0.0 110.916 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.86 -43.8 69.84 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.074 0.464 . . . . 0.0 111.405 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.9 t -61.82 -32.37 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.503 176.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.527 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 71.1 m-20 -72.89 -49.89 27.05 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.943 0.401 . . . . 0.0 111.226 179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.43 -34.69 78.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.809 0.337 . . . . 0.0 111.618 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.52 78.6 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.083 0.468 . . . . 0.0 111.485 176.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.74 -38.93 37.65 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.008 0.432 . . . . 0.0 111.53 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 108.86 -20.55 28.98 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.887 -174.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -129.59 160.23 33.91 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.685 0.394 . . . . 0.0 110.48 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.556 ' O ' HG22 ' A' ' 34' ' ' ILE . 32.7 mt -75.86 12.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 32.0 m-70 49.59 88.74 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.654 -0.654 . . . . 0.0 112.356 -178.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 4' ' ' ILE . 73.0 mt -117.45 155.88 28.93 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 122.156 -0.34 . . . . 0.0 110.628 176.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -141.9 149.03 39.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.67 -179.9 4.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.143 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -48.3 -63.3 3.76 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 121.463 -0.399 . . . . 0.0 114.054 -178.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -55.6 -50.03 71.21 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.248 0.546 . . . . 0.0 111.674 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -60.89 -33.42 73.08 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.862 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.76 -44.74 66.12 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.953 0.406 . . . . 0.0 111.012 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.48 -35.79 81.93 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.181 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.14 -56.87 11.78 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 120.895 0.378 . . . . 0.0 110.296 174.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 97.0 m -55.02 -31.62 61.2 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.274 176.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.83 -58.73 4.94 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.899 0.38 . . . . 0.0 111.176 175.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.81 69.01 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -87.54 -45.62 10.3 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -112.39 -52.11 2.8 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.587 ' HB3' HE22 ' A' ' 53' ' ' GLN . 97.1 m-85 -102.45 60.18 0.82 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.677 0.751 . . . . 0.0 111.521 -170.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -106.4 3.37 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.266 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.43 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -113.9 60.06 0.38 Allowed Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.916 171.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.587 HE22 ' HB3' ' A' ' 50' ' ' PHE . 6.8 mm-40 -73.69 110.07 7.7 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -108.9 -66.82 1.02 Allowed 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.454 0.539 . . . . 0.0 112.454 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -137.1 61.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.549 0.69 . . . . 0.0 110.902 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.416 HD21 ' OE1' ' A' ' 53' ' ' GLN . 0.9 OUTLIER -130.19 -179.96 5.54 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.171 179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 58.9 t -134.86 147.37 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.98 0.419 . . . . 0.0 111.675 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 70.2 tp -101.32 108.88 20.63 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.657 174.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 87.8 mt -84.75 147.84 26.66 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.887 0.375 . . . . 0.0 111.701 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.529 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -141.39 131.48 24.73 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 176.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 62.7 t -136.59 141.7 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -74.44 120.49 20.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.723 0.409 . . . . 0.0 111.15 173.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.538 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.61 -35.09 53.15 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -175.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -56.91 -55.28 45.33 Favored Pre-proline 0 CA--C 1.55 0.981 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -173.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -75.43 0.11 9.46 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.141 1.894 . . . . 0.0 114.301 -170.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 84.4 mt -65.28 -49.82 68.07 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 122.14 -0.35 . . . . 0.0 111.72 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.3 42.01 0.48 Allowed Glycine 0 CA--C 1.525 0.697 0 C-N-CA 121.185 -0.531 . . . . 0.0 112.701 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 55.65 20.41 3.89 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.544 ' HB3' ' HG3' ' A' ' 86' ' ' ARG . 8.8 m-20 -70.7 -16.07 62.76 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.983 0.42 . . . . 0.0 111.85 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 82' ' ' PRO . 39.4 tp -90.21 112.0 23.36 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.887 0.375 . . . . 0.0 110.929 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HD2' ' HB2' ' A' ' 73' ' ' GLU . 3.7 tmtp? -95.61 104.27 16.18 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.862 0.363 . . . . 0.0 110.904 -178.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 m95 -69.55 94.33 0.75 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 110.022 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.562 ' HB2' ' HD2' ' A' ' 71' ' ' LYS . 11.7 tp10 -122.27 138.39 54.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.773 -169.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 80' ' ' ARG . . . -83.32 176.47 9.1 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.37 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 21.1 t -168.42 -171.58 1.5 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.161 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 76' ' ' ARG . 39.7 mtp85 -54.07 97.75 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 111.467 -179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 144.36 -16.98 2.08 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.489 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.22 -4.17 77.9 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.902 176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -95.6 129.44 42.8 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 122.387 -0.478 . . . . 0.0 111.936 -178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 74' ' ' ALA . 87.5 mtt180 -80.29 109.46 14.79 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.978 0.418 . . . . 0.0 111.3 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -98.58 139.06 20.87 Favored Pre-proline 0 C--O 1.239 0.528 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 176.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.536 ' HB2' HD11 ' A' ' 70' ' ' LEU . 28.8 Cg_endo -63.24 97.22 0.19 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.279 1.986 . . . . 0.0 112.126 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -91.14 104.94 17.45 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.053 0.454 . . . . 0.0 111.995 -177.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.429 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 51.3 tp -97.46 122.5 40.58 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.726 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -106.26 16.88 24.26 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 121.209 0.528 . . . . 0.0 111.424 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HG3' ' HB3' ' A' ' 69' ' ' ASP . 18.7 mmm180 -112.03 130.78 22.91 Favored Pre-proline 0 N--CA 1.47 0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.83 -176.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.29 116.32 2.88 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.658 2.239 . . . . 0.0 112.709 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 50.0 tp -74.13 95.26 2.54 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 121.072 0.463 . . . . 0.0 111.622 -175.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.3 mt -59.67 122.9 15.27 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 177.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.532 HG21 ' HA ' ' A' ' 17' ' ' LYS . 83.0 t -61.58 -34.1 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.875 0.369 . . . . 0.0 111.966 -176.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -72.74 0.32 11.15 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 177.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -118.56 -1.15 11.23 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.866 0.365 . . . . 0.0 111.302 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.407 HG23 ' HA ' ' A' ' 90' ' ' VAL . 79.8 t -74.3 139.26 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 122.183 -0.323 . . . . 0.0 111.539 -179.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 37.0 m -69.36 -59.44 2.99 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 95' ' ' ARG . 1.9 mmp_? -147.07 151.1 36.33 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 8.0 pt-20 -129.92 95.91 4.07 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.891 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -98.56 132.07 44.27 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -73.99 149.92 41.02 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.68 171.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.511 HD23 ' N ' ' A' ' 99' ' ' LEU . 1.9 pt? -150.85 146.22 26.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.094 0.473 . . . . 0.0 112.091 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -127.71 -161.49 1.09 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.81 177.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.43 HD11 ' HA2' ' A' ' 52' ' ' GLY . 98.1 mt -117.22 135.74 53.57 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.956 0.725 . . . . 0.0 112.956 -174.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -143.72 -175.55 4.62 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.665 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.83 -78.19 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 177.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -139.13 17.92 2.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.651 0.739 . . . . 0.0 110.223 -178.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 100.2 32.47 5.53 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.093 -173.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.6 t -116.95 132.2 23.56 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 122.52 0.328 . . . . 0.0 110.665 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -79.17 77.3 4.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.865 1.71 . . . . 0.0 111.163 171.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.07 83.72 0.51 Allowed 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 122.733 1.254 . . . . 0.0 111.577 -174.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 6.39 0.27 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.256 -1.338 . . . . 0.0 113.216 -178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.32 -25.97 4.61 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 121.431 -0.414 . . . . 0.0 113.644 178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.5 -36.65 84.87 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.596 0.713 . . . . 0.0 110.658 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -76.7 -23.91 53.12 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.335 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.8 mt -105.66 160.76 14.95 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.917 0.389 . . . . 0.0 111.76 -174.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -91.83 -83.17 0.29 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.426 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 58.36 172.61 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 . . . . . 0 CA--C 1.547 0.846 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 178.042 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.4 mtm . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.8 p 54.97 128.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.2 mt -125.66 150.99 47.14 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.5 178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -125.02 149.8 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 120.726 0.298 . . . . 0.0 110.757 174.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.421 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.1 m-85 -130.9 141.46 50.3 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 35' ' ' HIS . 24.9 ttmm -134.91 127.45 30.66 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.999 173.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.4 mp -101.3 130.74 50.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.2 pt? -154.94 166.27 34.08 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.789 177.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 55' ' ' ASN . 57.4 p -78.46 143.15 36.95 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 122.185 -0.322 . . . . 0.0 110.381 178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' HB3' ' A' ' 13' ' ' TRP . 79.7 ttt180 -60.97 -25.2 66.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.0 -32.15 67.64 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.03 0.443 . . . . 0.0 111.288 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -89.51 -34.82 16.26 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 121.244 0.545 . . . . 0.0 110.982 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.552 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 15.8 t-105 -62.02 -53.92 48.8 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.885 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -58.59 -30.4 67.17 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 177.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.084 0.469 . . . . 0.0 110.191 172.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.7 -48.84 79.75 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.633 177.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HA ' HG21 ' A' ' 90' ' ' VAL . 56.7 mtmt -62.16 -30.9 71.37 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.58 -36.89 63.05 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.12 0.486 . . . . 0.0 110.976 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -71.66 -25.74 62.25 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.769 177.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 87.69 -15.69 53.71 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.206 -175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.548 ' NH2' ' HG2' ' A' ' 87' ' ' PRO . 49.4 ttt180 -140.03 147.2 40.02 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.115 0.483 . . . . 0.0 111.461 -177.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -116.46 88.05 2.81 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.793 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.73 -15.43 62.82 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.027 0.441 . . . . 0.0 111.313 176.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 133.69 175.49 13.95 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.993 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.6 p -75.3 -176.94 3.29 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 122.634 -0.333 . . . . 0.0 110.457 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.58 62.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.222 0.534 . . . . 0.0 110.637 172.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.3 t -78.04 -52.14 16.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.583 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -58.02 -42.32 85.05 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.925 0.393 . . . . 0.0 111.245 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.65 -35.16 74.94 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.338 179.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.0 -51.72 68.49 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 110.917 175.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.37 -34.9 76.88 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.138 0.494 . . . . 0.0 111.485 174.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.52 -40.42 2.59 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.394 -175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -98.17 117.91 33.6 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.488 0.315 . . . . 0.0 110.827 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.538 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 64.5 mt -64.78 122.42 15.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.413 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 47.4 m-70 -83.58 124.85 31.19 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.365 175.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.698 HD13 HG13 ' A' ' 4' ' ' ILE . 98.9 mt -113.35 -64.42 1.31 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.485 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 26.5 m 73.46 154.95 0.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.207 0.527 . . . . 0.0 111.85 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.08 -176.63 5.2 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.07 -64.73 3.91 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 114.285 0.474 . . . . 0.0 114.285 -174.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 9.7 mp0 -56.54 -47.59 79.1 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 117.082 0.441 . . . . 0.0 111.117 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 29.9 mt-30 -57.09 -35.77 69.8 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.968 -179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.31 -48.87 60.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.871 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.689 ' HB2' HD22 ' A' ' 109' ' ' LEU . 37.1 tt0 -65.86 -34.95 79.33 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.365 -0.209 . . . . 0.0 111.488 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.1 mt-10 -64.42 -51.08 64.99 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 175.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.6 m -60.2 -40.31 89.63 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.248 0.547 . . . . 0.0 110.463 175.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.638 ' HB1' ' HG2' ' A' ' 51' ' ' ARG . . . -61.43 -47.41 85.86 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.709 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' HB2' HG11 ' A' ' 106' ' ' VAL . . . -54.19 -41.12 68.23 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.315 0.578 . . . . 0.0 111.973 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -86.36 -41.81 14.2 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.684 -176.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.8 -6.04 13.86 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -166.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -144.71 -69.65 0.29 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.638 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 25.4 mmt180 -57.99 93.0 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.719 0.771 . . . . 0.0 112.918 -173.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -179.41 26.93 0.05 OUTLIER Glycine 0 CA--C 1.525 0.685 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.01 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.746 HE21 HD21 ' A' ' 56' ' ' LEU . 11.5 pt20 -165.8 176.47 7.92 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.747 0.308 . . . . 0.0 111.627 -174.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.81 166.98 14.2 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' SER . 87.6 m-20 65.08 19.48 11.82 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 175.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.746 HD21 HE21 ' A' ' 53' ' ' GLN . 65.1 mt -84.81 93.47 8.49 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.97 139.62 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.179 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.423 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 63.3 tp -107.4 99.92 9.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.814 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 74.2 mt -75.96 105.36 6.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.983 0.42 . . . . 0.0 111.027 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.21 102.6 12.58 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.767 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -105.2 139.82 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.802 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 94' ' ' THR . 4.2 mm-40 -79.29 115.33 18.88 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.554 0.216 . . . . 0.0 110.741 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.43 21.36 1.19 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.326 0.584 . . . . 0.0 111.192 177.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.59 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 32.6 tt0 -71.17 -41.1 10.21 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -176.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 11.7 Cg_endo -55.71 -67.01 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 121.742 1.628 . . . . 0.0 111.865 173.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.84 58.56 5.33 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 121.122 0.487 . . . . 0.0 112.278 171.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -98.43 -109.41 2.87 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.364 -0.446 . . . . 0.0 112.448 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 14.58 27.21 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.618 0.723 . . . . 0.0 110.558 173.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.568 ' HA ' HH11 ' A' ' 86' ' ' ARG . 0.8 OUTLIER -89.88 -69.54 0.71 Allowed 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.165 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.505 HD13 HD12 ' A' ' 36' ' ' LEU . 58.7 tp -100.29 134.54 43.08 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -176.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -124.39 128.34 48.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.756 0.312 . . . . 0.0 111.639 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -74.0 106.59 5.76 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.09 136.6 51.41 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -174.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -132.72 102.98 5.89 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -176.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 78.9 p -54.59 -48.28 72.33 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.154 0.502 . . . . 0.0 111.577 175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -80.38 5.57 14.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.402 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 80.72 -67.13 3.6 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.158 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.51 144.71 29.56 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.899 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 66.14 95.93 0.06 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.168 0.509 . . . . 0.0 111.19 -175.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.82 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 68.7 mtp180 -87.31 117.53 26.14 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.815 -172.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.409 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 65.4 m-85 -90.07 113.08 55.89 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.193 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 81' ' ' PHE . 19.5 Cg_endo -60.52 115.05 2.41 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.959 1.773 . . . . 0.0 112.052 174.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -115.63 136.88 52.62 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.933 0.397 . . . . 0.0 111.453 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.538 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 38.1 tp -98.44 107.13 19.52 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.099 0.476 . . . . 0.0 110.511 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -83.26 30.77 0.46 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -175.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.568 HH11 ' HA ' ' A' ' 69' ' ' ASP . 4.2 ptm180 -159.14 143.93 11.51 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 122.328 -0.232 . . . . 0.0 111.274 -177.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.548 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 13.9 Cg_endo -57.38 119.14 6.21 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 122.603 2.202 . . . . 0.0 112.945 177.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 tp -72.49 148.6 44.92 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.779 -174.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.495 HD23 ' HG3' ' A' ' 21' ' ' ARG . 42.9 mt -96.67 146.81 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 122.102 -0.374 . . . . 0.0 110.529 177.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.434 HG21 ' HA ' ' A' ' 17' ' ' LYS . 78.0 t -64.04 -39.74 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 O-C-N 122.05 -0.406 . . . . 0.0 111.427 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.9 t -72.17 -7.59 50.04 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.087 0.47 . . . . 0.0 111.1 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 89' ' ' LEU . 26.6 tt0 -97.9 -7.3 30.51 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 121.408 0.623 . . . . 0.0 110.518 177.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.4 t -85.82 110.74 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.847 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.684 HG22 ' HD3' ' A' ' 95' ' ' ARG . 4.0 m -64.59 -67.91 0.4 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' A' ' 94' ' ' THR . 1.3 mpp_? -115.18 130.9 57.04 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 14.3 pt-20 -103.07 87.8 3.0 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.579 0.704 . . . . 0.0 109.641 169.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -85.23 140.2 31.06 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -171.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -83.58 157.37 22.32 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.134 0.492 . . . . 0.0 111.361 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.602 HD23 ' H ' ' A' ' 99' ' ' LEU . 2.7 pt? -85.64 119.29 25.81 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.498 0.666 . . . . 0.0 112.758 -176.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -114.18 94.36 4.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 166.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.587 ' HB3' ' HA2' ' A' ' 105' ' ' GLY . 65.5 mt -102.6 158.23 16.38 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -159.71 172.18 18.2 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.1 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.5 -82.91 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -117.59 8.67 12.93 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.113 0.482 . . . . 0.0 111.121 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 101' ' ' LEU . . . 71.57 29.7 67.49 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.145 -0.55 . . . . 0.0 113.012 -174.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.847 ' H ' ' HD3' ' A' ' 107' ' ' PRO . 24.1 t -136.4 -22.1 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.453 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.847 ' HD3' ' H ' ' A' ' 106' ' ' VAL . 21.1 Cg_endo -90.25 50.2 1.03 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 121.697 1.598 . . . . 0.0 113.94 -163.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.649 ' H ' ' NE2' ' A' ' 108' ' ' GLN . 0.0 OUTLIER -126.14 26.03 6.58 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 -171.759 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.689 HD22 ' HB2' ' A' ' 43' ' ' GLN . 1.5 mp -100.65 -12.25 19.33 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.07 -9.17 46.55 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.277 -0.487 . . . . 0.0 112.389 177.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -83.23 -30.21 27.86 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.259 0.552 . . . . 0.0 111.198 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -100.56 -44.15 5.95 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.262 -172.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.28 -68.33 0.57 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.378 0.609 . . . . 0.0 111.051 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -84.29 138.33 32.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.176 178.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.462 HD22 ' N ' ' A' ' 115' ' ' LEU . 3.1 mm? -76.55 69.45 2.98 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.492 0.663 . . . . 0.0 110.323 179.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 . . . . . 0 CA--C 1.537 0.455 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.316 -174.611 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.537 0.208 . . . . 0.0 111.428 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p -62.85 158.18 19.57 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.909 0.385 . . . . 0.0 111.538 174.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -99.63 144.08 29.13 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.069 0.461 . . . . 0.0 111.701 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.558 ' O ' ' HA ' ' A' ' 60' ' ' ALA . 5.2 mt -107.14 146.0 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.405 178.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 34.3 m-85 -134.97 138.71 44.28 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -176.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.551 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 67.2 tttt -151.18 122.65 7.89 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.982 0.42 . . . . 0.0 111.372 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.533 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -94.29 135.78 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.126 -178.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.467 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -150.23 167.45 26.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.89 0.376 . . . . 0.0 111.093 178.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 t -71.1 149.34 46.57 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.728 0.299 . . . . 0.0 111.301 177.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -56.05 -38.91 71.25 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.875 0.369 . . . . 0.0 110.918 177.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.3 77.54 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.025 0.44 . . . . 0.0 111.699 178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -69.7 -40.28 76.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.149 0.5 . . . . 0.0 111.164 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.495 ' NE1' ' HE3' ' A' ' 17' ' ' LYS . 22.1 t-105 -73.23 -46.13 51.97 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.891 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -60.16 -41.21 92.31 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.827 0.346 . . . . 0.0 110.965 176.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.36 82.03 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.165 0.507 . . . . 0.0 110.846 174.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 13' ' ' TRP . . . -59.01 -47.55 84.78 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.147 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HE3' ' NE1' ' A' ' 13' ' ' TRP . 96.2 mttt -60.06 -37.81 80.96 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.306 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.87 90.7 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.848 0.356 . . . . 0.0 111.807 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.47 ' HG3' ' H ' ' A' ' 21' ' ' ARG . 28.6 pt20 -94.92 -3.02 49.41 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.804 0.335 . . . . 0.0 111.812 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.67 6.96 60.38 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.505 -0.379 . . . . 0.0 113.293 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 19' ' ' GLN . 68.6 mtt180 -143.8 157.44 44.37 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 122.505 -0.409 . . . . 0.0 111.408 -175.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 23' ' ' GLU . 46.7 t80 -134.83 178.84 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 170.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 87' ' ' PRO . 67.3 mm-40 92.45 156.12 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.246 1.019 . . . . 0.0 113.703 172.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.04 42.52 24.38 Favored Glycine 0 CA--C 1.526 0.751 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.548 -170.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 83.1 p -81.56 -176.63 6.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 120.713 0.292 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.55 -51.01 61.73 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.701 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 36.2 t -69.88 -51.17 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -54.72 -44.17 73.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 120.864 0.364 . . . . 0.0 111.669 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.13 -35.23 69.06 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.66 -44.04 90.02 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.901 0.381 . . . . 0.0 111.408 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -69.84 -39.3 76.51 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.983 0.42 . . . . 0.0 111.07 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 129.41 -25.07 4.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.123 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -159.04 161.44 36.55 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.685 0.394 . . . . 0.0 110.663 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.439 ' CD1' ' HB3' ' A' ' 23' ' ' GLU . 66.0 mt -61.82 140.0 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.143 0.497 . . . . 0.0 112.312 -173.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -139.32 105.97 5.36 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.053 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 3.8 mp -98.21 -175.41 3.11 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.515 175.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.5 m -131.97 155.37 48.09 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.22 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.31 173.23 12.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.657 174.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.92 -57.41 11.06 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.187 -0.53 . . . . 0.0 113.667 -177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.05 -42.79 99.8 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.122 0.486 . . . . 0.0 111.505 178.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -74.29 -15.1 60.98 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.914 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -70.85 -49.77 42.52 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.093 0.473 . . . . 0.0 110.686 176.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 109' ' ' LEU . 6.4 tp-100 -61.5 -36.99 82.06 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.089 0.471 . . . . 0.0 110.639 174.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.1 -47.18 85.78 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.143 0.497 . . . . 0.0 110.873 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 92.7 m -61.55 -31.23 71.25 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.059 0.457 . . . . 0.0 110.811 175.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' A' ' 50' ' ' PHE . . . -65.59 -58.43 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.812 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.61 -30.56 55.08 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.982 0.42 . . . . 0.0 112.12 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -84.69 -49.24 8.68 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -116.55 -35.4 4.25 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -169.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.545 ' HB2' ' HA ' ' A' ' 46' ' ' ALA . 98.5 m-85 -114.06 59.08 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.612 0.72 . . . . 0.0 110.728 -176.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -72.0 -4.66 29.89 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.25 -0.886 . . . . 0.0 112.797 -174.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.57 -96.76 0.1 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.56 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.0 mt-30 59.79 -164.08 0.22 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.613 0.365 . . . . 0.0 111.651 -176.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -125.63 120.49 30.9 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.858 -0.526 . . . . 0.0 111.7 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 57.5 83.12 0.11 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.01 0.524 . . . . 0.0 112.185 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 53' ' ' GLN . 79.6 mt -99.09 123.55 43.46 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.576 177.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.423 ' O ' HD23 ' A' ' 8' ' ' LEU . 48.4 t -87.73 127.62 40.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HB2' HD11 ' A' ' 99' ' ' LEU . 67.4 tp -99.6 99.77 10.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.274 174.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 89.0 mt -75.61 107.72 7.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.751 177.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.558 ' HA ' ' O ' ' A' ' 4' ' ' ILE . . . -117.29 114.05 23.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.601 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 94' ' ' THR . 43.5 t -127.0 142.53 43.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.487 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.494 ' O ' ' HD2' ' A' ' 65' ' ' PRO . 0.7 OUTLIER -69.86 133.81 47.78 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.456 175.261 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -79.6 30.54 0.24 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -174.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.32 -41.59 2.41 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 122.039 -0.413 . . . . 0.0 111.772 174.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' A' ' 62' ' ' GLU . 18.2 Cg_exo -70.27 39.21 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.591 2.194 . . . . 0.0 112.405 168.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.494 HD12 ' HB3' ' A' ' 70' ' ' LEU . 48.8 tp -61.68 -41.93 98.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.565 0.746 . . . . 0.0 112.394 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 60.71 -114.87 7.02 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.171 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -152.9 10.61 0.47 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.365 0.602 . . . . 0.0 110.966 175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -102.16 -26.18 13.45 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.494 ' HB3' HD12 ' A' ' 66' ' ' LEU . 38.6 tp -70.5 96.77 1.21 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.438 0.637 . . . . 0.0 110.291 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.585 ' HG2' ' HB2' ' A' ' 73' ' ' GLU . 39.1 ttmt -103.26 102.29 12.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.68 -175.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 45.7 m95 -70.42 98.14 1.38 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 71' ' ' LYS . 9.7 tp10 -137.9 159.9 40.76 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.716 -169.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.37 179.15 4.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.071 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 88.5 p -134.6 -68.76 0.53 Allowed 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.036 0.446 . . . . 0.0 111.346 179.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.2 mmm180 -106.42 -66.8 0.98 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -84.77 -107.2 0.63 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.295 -178.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.61 -163.45 10.21 Favored Glycine 0 CA--C 1.522 0.528 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.928 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 69.7 143.87 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.426 0.631 . . . . 0.0 112.43 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.42 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 79.8 mtt180 -100.27 117.79 35.21 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.056 0.455 . . . . 0.0 111.747 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -97.96 129.76 30.32 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.447 174.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.487 ' HB2' HD11 ' A' ' 70' ' ' LEU . 37.8 Cg_endo -66.83 103.93 0.76 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.117 1.878 . . . . 0.0 112.533 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' LEU . 74.6 m80 -96.51 154.29 17.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.078 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.0 mt -129.74 145.93 51.52 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.465 0.65 . . . . 0.0 112.358 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -114.12 10.19 17.35 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.836 171.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.421 ' HA ' ' HE ' ' A' ' 86' ' ' ARG . 1.4 mmp_? -118.43 133.97 23.48 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.238 177.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 23' ' ' GLU . 14.2 Cg_exo -68.51 136.81 37.61 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 121.601 1.534 . . . . 0.0 111.583 173.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.94 101.48 6.87 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.292 0.568 . . . . 0.0 111.707 -171.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 65.8 mt -63.96 120.13 11.39 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.309 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.409 HG11 ' HG2' ' A' ' 17' ' ' LYS . 80.2 t -53.38 -36.14 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.067 0.46 . . . . 0.0 111.565 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.3 t -60.07 -30.43 69.21 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -79.76 -20.23 46.8 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.832 0.349 . . . . 0.0 111.49 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.7 124.94 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 120.683 0.278 . . . . 0.0 111.668 -178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.469 HG23 HG13 ' A' ' 61' ' ' VAL . 82.6 p -77.18 -57.72 3.68 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 60' ' ' ALA . 6.7 ptp85 -131.54 145.41 51.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.144 0.497 . . . . 0.0 112.113 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.416 ' CD ' ' HE1' ' A' ' 13' ' ' TRP . 8.1 pt-20 -122.36 97.73 5.6 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.145 0.498 . . . . 0.0 111.037 176.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.513 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -82.75 118.49 23.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 111.648 -176.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -84.32 105.86 15.48 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.094 0.473 . . . . 0.0 110.486 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 58' ' ' LEU . 73.2 mt -82.85 103.35 12.26 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.188 0.518 . . . . 0.0 112.386 -173.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -91.6 142.01 28.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.194 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.5 mt -75.61 127.21 32.58 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -176.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -134.73 167.79 20.2 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.631 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.63 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 173.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -100.49 3.91 43.27 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.643 0.259 . . . . 0.0 111.664 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.51 22.55 72.56 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.136 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.9 t -123.14 136.34 26.88 Favored Pre-proline 0 N--CA 1.471 0.588 0 C-N-CA 123.248 0.619 . . . . 0.0 110.256 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 53.1 Cg_exo -54.35 117.68 4.2 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.676 2.251 . . . . 0.0 113.761 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -75.39 98.24 3.83 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.8 mp -100.43 -40.63 7.38 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.988 -0.445 . . . . 0.0 111.76 173.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -49.03 -42.9 31.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.617 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -89.56 -29.34 18.97 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -66.44 -33.3 75.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 59.8 mt -80.8 161.69 24.38 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.566 -178.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -94.92 -74.8 0.53 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.113 -176.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 56.2 tp 61.08 102.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.236 0.541 . . . . 0.0 111.4 -175.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 . . . . . 0 CA--C 1.537 0.447 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.374 -176.505 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.9 mtp . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.623 0.249 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 32.6 m -70.64 126.81 30.66 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.78 0.324 . . . . 0.0 111.817 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.8 mt -111.59 130.0 55.89 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.627 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.501 HG13 HD22 ' A' ' 36' ' ' LEU . 16.8 pt -114.32 132.22 64.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-O 121.335 0.588 . . . . 0.0 110.935 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.797 ' HB3' HD21 ' A' ' 58' ' ' LEU . 32.3 m-85 -107.6 135.2 49.45 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.015 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.597 ' HE3' ' HE2' ' A' ' 22' ' ' PHE . 50.0 tttm -120.8 124.23 44.55 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 122.355 -0.215 . . . . 0.0 111.207 175.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.544 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.2 mp -93.23 136.91 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.505 HD21 ' HG ' ' A' ' 59' ' ' LEU . 2.2 pt? -153.87 174.01 15.15 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.023 0.44 . . . . 0.0 111.622 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -85.87 150.65 24.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.971 0.415 . . . . 0.0 111.41 175.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -34.14 70.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.01 0.433 . . . . 0.0 110.248 177.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.89 -39.55 85.71 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.444 178.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.48 ' OE1' ' HB2' ' A' ' 25' ' ' SER . 52.7 mt-10 -62.45 -53.32 56.54 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.341 0.591 . . . . 0.0 110.908 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.411 ' CH2' HG13 ' A' ' 90' ' ' VAL . 47.0 t-105 -60.91 -60.36 3.91 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.612 -174.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.548 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -61.18 -31.59 71.34 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.357 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -65.4 -59.16 4.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.011 0.434 . . . . 0.0 110.67 174.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.7 69.36 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.993 0.425 . . . . 0.0 111.808 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.599 ' HA ' HG21 ' A' ' 90' ' ' VAL . 37.2 ttpt -71.21 -26.69 63.05 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.931 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.56 -30.62 52.73 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.081 0.467 . . . . 0.0 110.819 172.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 7.7 mm-40 -78.97 -29.63 44.01 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.934 176.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.52 -2.48 65.01 Favored Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.157 -0.474 . . . . 0.0 113.214 -178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 10.3 ptm180 -148.21 125.24 11.36 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 122.404 -0.468 . . . . 0.0 111.925 -174.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.597 ' HE2' ' HE3' ' A' ' 6' ' ' LYS . 53.6 t80 -93.84 116.96 29.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.04 0.448 . . . . 0.0 110.505 176.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -109.96 9.96 24.32 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -174.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.95 175.6 20.93 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.844 -0.693 . . . . 0.0 114.551 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.48 ' HB2' ' OE1' ' A' ' 12' ' ' GLU . 38.8 t -128.52 -175.81 3.63 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.006 0.522 . . . . 0.0 110.889 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.46 -33.02 63.26 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.405 HG12 ' CE1' ' A' ' 35' ' ' HIS . 41.3 t -70.76 -45.91 71.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.418 0.627 . . . . 0.0 111.051 177.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.515 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 14.7 m-20 -62.6 -38.6 90.8 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.898 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.7 mt -73.55 -21.92 60.23 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.648 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.5 -39.98 85.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.053 0.454 . . . . 0.0 110.877 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.46 -59.4 2.75 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.368 0.604 . . . . 0.0 110.734 171.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 154.71 -49.32 0.49 Allowed Glycine 0 CA--C 1.525 0.68 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.737 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -128.93 169.43 14.65 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.607 0.363 . . . . 0.0 110.852 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 64.0 mt -54.59 134.06 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.824 0.345 . . . . 0.0 111.274 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.515 ' CD2' ' HA ' ' A' ' 28' ' ' ASP . 25.5 p80 -143.3 123.61 13.82 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.212 0.53 . . . . 0.0 111.761 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 6' ' ' LYS . 5.0 mp -96.58 -163.06 1.01 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.676 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' HB2' ' A' ' 41' ' ' GLN . 81.9 p -137.76 150.09 46.97 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.837 0.351 . . . . 0.0 111.327 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -98.91 109.53 22.27 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -176.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 55.78 -103.78 0.26 Allowed Glycine 0 CA--C 1.53 1.002 0 N-CA-C 114.579 0.592 . . . . 0.0 114.579 173.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.06 -42.01 84.55 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.788 0.328 . . . . 0.0 111.642 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 53.0 mt-30 -53.21 -28.71 28.24 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.017 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.48 -56.56 13.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.486 178.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -61.43 -43.04 99.57 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.373 178.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 18.8 mm-40 -55.55 -57.0 13.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.943 177.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 84.6 m -57.3 -38.46 74.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.942 0.401 . . . . 0.0 111.363 178.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.15 83.38 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.966 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.86 -24.65 28.47 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 44' ' ' GLU . 67.1 mttm -88.87 -59.01 2.34 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 72.3 m95 -97.18 -33.87 11.33 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -170.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -98.75 64.47 1.48 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.506 0.669 . . . . 0.0 110.853 -173.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 51' ' ' ARG . 4.5 mmp_? -109.36 139.14 44.69 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.804 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.24 39.85 93.06 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 114.959 0.744 . . . . 0.0 114.959 174.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.558 ' HB2' HD21 ' A' ' 56' ' ' LEU . 45.0 mt-30 -116.14 142.74 46.42 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 117.351 0.576 . . . . 0.0 111.116 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.49 127.63 32.44 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 58.95 84.1 0.11 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.429 177.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.558 HD21 ' HB2' ' A' ' 53' ' ' GLN . 85.6 mt -101.65 134.96 43.97 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.274 178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.8 t -113.09 152.96 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 110.928 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 5' ' ' TYR . 3.2 tt -129.2 114.88 16.85 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.008 0.433 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' HD21 ' A' ' 8' ' ' LEU . 86.5 mt -90.83 107.22 19.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.996 0.426 . . . . 0.0 110.873 177.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.523 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -95.87 107.37 19.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.505 177.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.23 143.91 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.014 -178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -72.27 127.97 34.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 122.096 -0.377 . . . . 0.0 110.604 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.15 -47.91 71.42 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.037 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 63.38 161.86 0.12 Allowed Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.79 -62.15 0.23 Allowed 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.485 2.123 . . . . 0.0 112.963 171.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 19.0 66.03 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -44.46 130.95 7.38 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 115.067 -0.969 . . . . 0.0 114.918 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 78.66 -24.67 0.21 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -69.0 -42.29 76.67 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.648 -0.657 . . . . 0.0 111.053 172.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.5 tp -102.99 143.3 32.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 111.01 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -153.61 132.08 12.11 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.809 178.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 80' ' ' ARG . 93.0 m95 -77.84 64.05 3.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.701 0.762 . . . . 0.0 110.55 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -80.03 132.56 36.02 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.644 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -147.23 165.8 28.96 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.122 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 55.7 m -122.42 -178.08 3.8 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.779 -175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 54.1 mtm180 75.18 -47.37 0.61 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 165.43 -34.42 0.25 Allowed Glycine 0 CA--C 1.524 0.624 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.689 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.22 -149.08 5.35 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.294 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 64.03 -175.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.124 0.488 . . . . 0.0 111.951 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.414 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 38.4 ptt180 -160.07 135.74 8.36 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 120.783 0.325 . . . . 0.0 111.369 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.425 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 92.3 m-85 -131.21 123.21 19.57 Favored Pre-proline 0 CA--C 1.538 0.495 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 173.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.64 95.06 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 121.942 1.761 . . . . 0.0 112.637 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 81' ' ' PHE . 12.0 m170 -88.36 123.12 32.62 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.19 177.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 32.9 tp -101.35 112.56 25.12 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.273 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -82.15 8.25 11.41 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -174.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -111.36 148.64 39.21 Favored Pre-proline 0 N--CA 1.473 0.689 0 O-C-N 122.034 -0.416 . . . . 0.0 110.904 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.66 109.47 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.022 1.815 . . . . 0.0 110.975 171.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.43 104.69 1.29 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.303 0.573 . . . . 0.0 110.825 -171.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.21 137.27 50.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.107 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.599 HG21 ' HA ' ' A' ' 17' ' ' LYS . 68.0 t -57.68 -34.73 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 121.264 0.554 . . . . 0.0 111.043 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.8 m -69.46 -9.24 52.83 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.835 -0.621 . . . . 0.0 112.183 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -105.91 -6.99 18.44 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.926 0.393 . . . . 0.0 111.826 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 59' ' ' LEU . 58.7 t -69.74 110.46 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 O-C-N 122.024 -0.422 . . . . 0.0 111.233 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 85.1 m -48.81 -58.52 4.68 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -147.78 138.42 23.18 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.358 0.599 . . . . 0.0 112.104 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.89 118.88 35.46 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.442 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.97 108.45 12.95 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 122.025 -0.422 . . . . 0.0 111.969 -178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -77.0 126.59 31.23 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.234 0.54 . . . . 0.0 110.866 176.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 81.8 mt -83.87 111.1 18.92 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -74.85 -11.72 60.21 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 177.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.3 mt 65.64 -167.43 0.21 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.693 0.397 . . . . 0.0 111.261 -176.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -149.05 -172.85 4.22 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 122.289 -0.257 . . . . 0.0 110.819 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.49 -28.49 65.42 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -88.68 -3.63 58.74 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.148 0.499 . . . . 0.0 110.649 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 81.11 -6.83 61.79 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 116.057 -0.519 . . . . 0.0 112.989 -176.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.98 133.34 39.41 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.669 -0.312 . . . . 0.0 111.344 -178.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.96 118.63 5.66 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.158 1.905 . . . . 0.0 112.354 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -66.3 97.99 0.44 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.34 0.59 . . . . 0.0 112.186 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.1 mp -100.17 -15.78 18.02 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.948 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -53.84 -33.39 49.61 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.759 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -68.54 -37.04 79.62 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 122.799 0.44 . . . . 0.0 111.652 174.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -85.45 -30.17 23.73 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -173.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.416 ' HB3' HD13 ' A' ' 115' ' ' LEU . 40.0 mt -89.95 169.34 11.3 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -100.74 8.08 43.48 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.871 0.367 . . . . 0.0 111.843 178.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.457 ' N ' HD12 ' A' ' 115' ' ' LEU . 6.4 mp -80.6 105.51 11.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.812 0.339 . . . . 0.0 111.327 -178.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 . . . . . 0 CA--C 1.54 0.591 0 CA-C-O 121.555 0.693 . . . . 0.0 111.717 -176.977 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 mtt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.71 0.291 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.521 HG22 ' HB3' ' A' ' 63' ' ' ALA . 14.0 m -83.37 121.89 27.74 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -171.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 62' ' ' GLU . 0.4 OUTLIER -128.46 132.0 48.39 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.931 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.605 HD12 HD22 ' A' ' 36' ' ' LEU . 14.1 pt -114.16 145.76 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.542 ' HB3' HD11 ' A' ' 58' ' ' LEU . 77.9 m-85 -123.81 146.5 48.31 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.726 -176.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.54 ' HD3' ' HG ' ' A' ' 36' ' ' LEU . 6.4 ttpm? -156.35 125.28 5.99 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.252 -0.28 . . . . 0.0 111.433 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 55.6 mt -94.91 135.94 27.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 120.797 0.332 . . . . 0.0 111.808 -178.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -143.79 172.03 13.4 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.624 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.6 m -76.0 142.57 41.85 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.852 0.358 . . . . 0.0 111.587 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -55.94 -44.17 78.12 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.56 80.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.15 0.5 . . . . 0.0 112.127 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -69.42 -43.25 73.76 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.039 0.447 . . . . 0.0 110.95 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 58.6 t-105 -66.54 -34.75 78.6 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.628 177.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 24.4 t70 -60.04 -52.08 66.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.338 0.589 . . . . 0.0 110.432 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -55.32 -39.99 70.62 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.105 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 22' ' ' PHE . . . -59.82 -45.77 91.31 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.397 175.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.55 ' HA ' HG21 ' A' ' 90' ' ' VAL . 10.5 mtmp? -61.0 -36.0 78.33 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.859 0.361 . . . . 0.0 111.054 176.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -42.41 98.99 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.136 0.494 . . . . 0.0 111.129 174.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 77.0 mm-40 -70.74 -26.61 63.45 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.223 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.5 -1.51 61.1 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.406 -0.426 . . . . 0.0 112.405 -175.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 ttt-85 -150.77 134.57 16.6 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.099 0.56 . . . . 0.0 110.346 -173.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.513 ' HB2' ' HB1' ' A' ' 16' ' ' ALA . 90.1 t80 -134.9 130.25 35.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.85 0.357 . . . . 0.0 111.55 -176.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.677 ' HG2' ' H ' ' A' ' 24' ' ' GLY . 1.7 pm0 -100.69 -75.19 0.59 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.294 175.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.677 ' H ' ' HG2' ' A' ' 23' ' ' GLU . . . -157.88 -123.62 0.75 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.717 -176.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.44 ' H ' ' HB3' ' A' ' 28' ' ' ASP . 23.2 t -175.69 -164.94 0.15 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.583 -0.363 . . . . 0.0 111.1 -173.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.89 -63.29 1.23 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' A' ' 30' ' ' ALA . 7.6 p -55.8 -40.33 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-O 121.119 0.485 . . . . 0.0 111.509 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' ' 25' ' ' SER . 0.2 OUTLIER -57.04 -54.68 44.02 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.426 177.274 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.09 -13.4 61.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' VAL . . . -66.04 -54.66 23.09 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.753 0.311 . . . . 0.0 110.614 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.42 -42.19 25.99 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 120.655 0.264 . . . . 0.0 111.229 174.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 117.42 13.42 7.51 Favored Glycine 0 CA--C 1.529 0.962 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 170.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -148.41 139.27 23.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 117.852 0.826 . . . . 0.0 112.292 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mt -65.02 87.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.481 0.658 . . . . 0.0 111.157 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -93.29 112.07 23.89 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.233 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.605 HD22 HD12 ' A' ' 4' ' ' ILE . 4.8 mp -94.71 -160.65 0.79 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.667 176.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.5 p -142.88 153.03 42.73 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.867 0.365 . . . . 0.0 111.0 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.22 178.82 5.49 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.851 174.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.65 -67.56 2.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.035 -0.603 . . . . 0.0 113.653 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 3.3 mp0 -56.08 -42.77 77.22 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 122.642 -0.328 . . . . 0.0 111.12 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.503 ' NE2' ' HB1' ' A' ' 79' ' ' ALA . 82.8 mt-30 -56.56 -44.06 80.57 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.834 0.35 . . . . 0.0 111.428 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.41 95.96 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.995 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.602 ' HB2' HD11 ' A' ' 109' ' ' LEU . 34.2 tt0 -64.1 -37.98 89.4 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.605 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 46.8 mt-10 -62.51 -51.77 66.12 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.877 0.37 . . . . 0.0 110.956 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 63.9 m -60.84 -35.27 76.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.027 0.442 . . . . 0.0 110.886 176.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.526 ' HB1' ' HG3' ' A' ' 107' ' ' PRO . . . -67.85 -48.82 65.07 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.743 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.7 -14.82 55.68 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.073 0.463 . . . . 0.0 111.606 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -98.98 -63.05 1.16 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.412 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.5 m95 -84.9 -49.06 8.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.165 0.507 . . . . 0.0 112.136 -176.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -97.42 56.1 1.31 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.961 0.41 . . . . 0.0 111.469 -173.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.85 -33.95 38.52 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 170.77 44.99 0.03 OUTLIER Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.11 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.553 ' HB2' HD21 ' A' ' 56' ' ' LEU . 85.2 mt-30 -79.06 133.47 36.79 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.896 0.379 . . . . 0.0 111.713 -174.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -88.93 61.41 5.9 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.131 0.491 . . . . 0.0 112.154 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -171.79 29.9 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.439 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 53' ' ' GLN . 22.3 mt -106.56 141.77 37.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 88.1 t -125.88 117.55 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.548 174.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.542 HD11 ' HB3' ' A' ' 5' ' ' TYR . 66.0 tp -93.14 100.08 12.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.707 178.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.6 mt -75.81 109.35 9.35 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.719 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -99.57 112.04 24.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 175.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.1 t -120.72 138.33 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-O 121.008 0.433 . . . . 0.0 112.148 -175.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.491 ' HA ' HD22 ' A' ' 3' ' ' LEU . 9.0 pt-20 -69.23 108.4 3.63 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.722 0.772 . . . . 0.0 110.281 175.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.521 ' HB3' HG22 ' A' ' 2' ' ' THR . . . -85.69 1.56 48.9 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -169.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.55 ' HB2' ' HD3' ' A' ' 65' ' ' PRO . 39.8 mt-10 -80.76 -49.94 1.06 Allowed Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.55 ' HD3' ' HB2' ' A' ' 64' ' ' GLU . 76.0 Cg_exo -52.5 -48.63 20.9 Favored 'Trans proline' 0 C--N 1.36 1.179 0 C-N-CA 122.336 2.024 . . . . 0.0 113.06 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 pp -92.79 10.79 29.4 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -57.78 -28.29 60.16 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 114.652 0.621 . . . . 0.0 114.652 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -66.31 -26.44 67.31 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 117.361 0.581 . . . . 0.0 111.533 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.37 11.84 30.48 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.259 177.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 82' ' ' PRO . 42.0 tp -113.69 102.97 10.76 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.835 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.36 107.32 19.07 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 59.9 m95 -69.39 84.57 0.4 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.793 0.806 . . . . 0.0 109.489 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -119.85 120.49 36.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.287 -167.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.12 89.26 1.14 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.02 0.438 . . . . 0.0 111.409 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.5 p -75.2 78.89 2.32 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.685 178.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 mtp85 63.37 178.52 0.16 Allowed 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.498 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 76.65 -66.93 2.66 Favored Glycine 0 CA--C 1.524 0.643 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.97 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.58 -19.84 2.03 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.794 -178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.503 ' HB1' ' NE2' ' A' ' 41' ' ' GLN . . . -83.84 129.18 34.94 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.209 0.528 . . . . 0.0 112.006 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.3 mtp85 -70.85 104.35 2.89 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.478 176.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -94.4 123.27 59.09 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 120.802 0.334 . . . . 0.0 111.419 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 70' ' ' LEU . 40.9 Cg_endo -67.42 109.15 1.74 Allowed 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.531 2.154 . . . . 0.0 112.385 177.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -100.02 106.51 18.28 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.085 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.476 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 52.8 tp -93.5 138.67 31.56 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.97 0.414 . . . . 0.0 111.123 178.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.93 29.81 7.74 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.476 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 28.7 mmt180 -138.11 141.15 31.15 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 122.538 0.335 . . . . 0.0 111.711 -179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 23.2 Cg_exo -64.97 120.36 7.58 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.769 2.312 . . . . 0.0 112.298 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 62.7 tp -81.23 110.86 17.1 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.063 0.459 . . . . 0.0 111.527 -177.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.28 136.26 53.22 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 122.215 -0.303 . . . . 0.0 110.448 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 17' ' ' LYS . 91.4 t -58.37 -41.17 80.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.247 0.546 . . . . 0.0 110.935 178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.2 t -70.94 -10.08 59.03 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.828 176.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -95.73 -15.0 22.91 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.975 0.417 . . . . 0.0 111.333 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.25 145.0 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 120.968 0.413 . . . . 0.0 111.285 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 31.1 m -80.26 -50.77 9.76 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.909 0.385 . . . . 0.0 111.298 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.418 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 9.7 tpp180 -150.14 143.95 25.38 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.271 0.558 . . . . 0.0 111.788 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 9.1 pt-20 -116.41 98.76 6.75 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.081 173.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -89.09 87.36 7.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.165 0.507 . . . . 0.0 111.72 -176.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -67.95 103.93 1.6 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.333 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.3 tp 60.11 101.64 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.026 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 13.8 t70 -119.51 89.86 3.21 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.043 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.49 164.04 22.79 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 0.0 112.094 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.895 ' HB2' ' HB2' ' A' ' 108' ' ' GLN . 5.9 t70 -111.74 -169.41 1.46 Allowed 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.019 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.14 -25.75 61.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -176.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -89.41 0.93 56.49 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.179 0.514 . . . . 0.0 110.87 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 75.96 5.56 80.36 Favored Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.69 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.4 t -89.45 135.8 30.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 122.32 0.248 . . . . 0.0 110.509 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.526 ' HG3' ' HB1' ' A' ' 46' ' ' ALA . 20.4 Cg_endo -59.44 95.95 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.289 1.993 . . . . 0.0 111.586 175.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.895 ' HB2' ' HB2' ' A' ' 102' ' ' ASP . 2.6 tp-100 -83.83 44.53 1.0 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.732 0.777 . . . . 0.0 110.699 -174.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.602 HD11 ' HB2' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -65.12 5.82 0.32 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.145 -0.934 . . . . 0.0 113.186 -176.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -50.95 -34.95 31.46 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.688 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -65.08 -27.63 68.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.034 0.445 . . . . 0.0 111.281 174.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -80.26 -24.2 40.26 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 120.973 0.416 . . . . 0.0 110.745 173.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 22.5 mt -105.59 -159.22 0.7 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.77 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -145.82 -28.71 0.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.54 142.85 38.81 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 176.291 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ttt . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 120.805 0.336 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.0 m -74.54 -21.22 59.63 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -177.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.5 mt -75.37 99.43 4.13 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.948 0.404 . . . . 0.0 111.714 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.588 HD12 HD13 ' A' ' 36' ' ' LEU . 15.4 pt -104.86 142.66 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 110.69 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -125.19 152.22 44.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.225 0.536 . . . . 0.0 112.098 -172.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HZ1' ' CG ' ' A' ' 28' ' ' ASP . 62.6 tttp -147.54 106.66 3.86 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.613 175.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.9 mt -91.51 137.62 21.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.229 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -154.18 172.62 17.29 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.001 0.429 . . . . 0.0 111.268 178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 94.4 p -76.24 146.4 39.05 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.054 0.454 . . . . 0.0 111.43 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -41.92 62.07 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.555 -179.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.46 -51.07 71.46 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -65.81 -29.48 69.96 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.028 0.442 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -70.23 -44.69 68.04 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.143 175.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.81 -33.38 72.93 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.221 -0.3 . . . . 0.0 111.114 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.53 -40.96 88.9 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.853 175.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.58 79.52 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.379 174.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -58.6 -37.19 75.29 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.066 0.46 . . . . 0.0 111.211 177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.73 -52.77 61.96 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.687 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 11.5 pt20 -77.24 -10.47 59.44 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 81.41 -45.14 3.18 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-O 121.354 0.419 . . . . 0.0 112.678 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.41 ' HG2' HD23 ' A' ' 89' ' ' LEU . 48.0 mtm180 -94.17 -173.93 3.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.451 0.643 . . . . 0.0 111.208 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -141.23 94.68 2.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.581 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -72.42 -20.91 61.34 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.91 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.85 152.89 6.67 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.043 -0.526 . . . . 0.0 113.073 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 86.2 p -91.12 -171.66 3.05 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -47.97 -53.57 15.63 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 64.0 t -59.88 -53.75 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.517 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 12.9 m-20 -57.96 -47.5 82.75 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.237 0.541 . . . . 0.0 111.713 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.89 -16.81 62.71 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.697 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.93 -55.66 7.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -79.03 -51.59 9.38 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.44 -34.23 0.59 Allowed Glycine 0 CA--C 1.529 0.926 0 C-N-CA 120.298 -0.953 . . . . 0.0 114.561 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -131.1 157.08 44.07 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 117.455 0.627 . . . . 0.0 111.94 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.759 HD12 HD13 ' A' ' 88' ' ' LEU . 66.9 mt -70.58 114.83 9.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.577 0.703 . . . . 0.0 111.989 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -81.43 124.62 29.58 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.845 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 HD12 ' A' ' 4' ' ' ILE . 81.6 mt -109.82 111.31 22.66 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.702 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -77.85 105.85 9.31 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.288 0.566 . . . . 0.0 111.917 -174.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.91 101.92 3.94 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.95 -95.99 0.01 OUTLIER Glycine 0 CA--C 1.532 1.098 0 N-CA-C 114.706 0.643 . . . . 0.0 114.706 173.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.39 -43.48 61.93 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.287 0.565 . . . . 0.0 111.366 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.13 -37.08 85.8 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.173 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -61.08 -44.66 97.03 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.628 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -67.0 -36.9 83.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.26 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -61.38 -56.7 17.4 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.912 0.386 . . . . 0.0 110.805 175.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.9 m -57.59 -38.56 75.07 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.999 0.428 . . . . 0.0 111.377 176.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.87 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -68.34 -39.14 82.02 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.68 -19.25 60.34 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.869 0.366 . . . . 0.0 111.712 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -93.2 -57.88 2.48 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.102 0.477 . . . . 0.0 111.565 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.71 -55.72 3.84 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -92.29 17.75 9.3 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -171.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -64.97 113.76 4.09 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.934 0.397 . . . . 0.0 111.428 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.77 25.96 73.96 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 114.237 0.455 . . . . 0.0 114.237 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -99.97 163.46 12.43 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 117.352 0.576 . . . . 0.0 111.451 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -109.21 174.18 5.98 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.862 -179.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 62.52 26.01 15.47 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.841 0.456 . . . . 0.0 112.029 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 81.9 mt -88.47 111.48 21.86 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.75 135.61 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 121.006 0.431 . . . . 0.0 110.455 174.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.411 ' O ' HD23 ' A' ' 58' ' ' LEU . 7.4 tt -102.25 106.23 17.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.037 0.446 . . . . 0.0 110.465 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.496 HD22 HG21 ' A' ' 93' ' ' VAL . 61.3 mt -84.97 107.29 17.03 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.691 177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.514 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . -102.96 117.86 35.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.743 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 4' ' ' ILE . 53.4 t -117.57 116.24 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.518 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.62 95.77 0.89 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -42.53 -65.65 0.45 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 -170.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 64.75 158.35 0.12 Allowed Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 120.789 0.328 . . . . 0.0 110.976 -173.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 57.36 3.4 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.234 1.956 . . . . 0.0 112.809 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.603 HD12 ' N ' ' A' ' 67' ' ' GLY . 1.6 pp -67.32 -28.88 68.35 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.603 ' N ' HD12 ' A' ' 66' ' ' LEU . . . 176.35 154.08 11.31 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.741 -179.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.51 -23.89 67.58 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.118 0.485 . . . . 0.0 111.438 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -65.71 -9.54 28.76 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.107 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.577 ' HB2' HD13 ' A' ' 84' ' ' LEU . 57.8 tp -98.54 100.89 12.17 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 168.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -116.36 133.47 55.99 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.094 0.473 . . . . 0.0 112.067 -176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -73.97 91.51 2.03 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.33 0.586 . . . . 0.0 110.259 172.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.31 143.08 35.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.173 -174.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -115.2 91.85 3.74 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 174.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.3 m -69.7 168.39 15.03 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.859 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.0 tpp85 -58.19 95.64 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.089 0.471 . . . . 0.0 111.354 179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 152.87 -73.25 0.26 Allowed Glycine 0 CA--C 1.527 0.81 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.227 -178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 168.3 -158.26 30.89 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.364 -0.446 . . . . 0.0 113.015 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 62.29 -173.22 0.15 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -126.69 128.03 46.06 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.733 178.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -121.64 94.72 48.36 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.576 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.14 103.18 0.73 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 122.018 1.812 . . . . 0.0 112.226 178.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -101.41 115.52 30.7 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.336 -179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.577 HD13 ' HB2' ' A' ' 70' ' ' LEU . 30.2 tp -96.32 108.21 20.68 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.05 0.452 . . . . 0.0 109.938 175.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -81.0 55.32 2.44 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 120.891 0.377 . . . . 0.0 111.585 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -141.12 161.44 53.4 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.17 103.64 1.45 Allowed 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.532 2.155 . . . . 0.0 110.963 163.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.759 HD13 HD12 ' A' ' 34' ' ' ILE . 10.0 mp -75.71 122.86 24.64 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -169.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.41 HD23 ' HG2' ' A' ' 21' ' ' ARG . 33.1 mt -71.94 106.73 4.35 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.832 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.467 HG12 ' O ' ' A' ' 90' ' ' VAL . 42.3 t 54.14 39.1 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-O 122.2 1.0 . . . . 0.0 109.408 -171.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.753 ' HB2' HG23 ' A' ' 93' ' ' VAL . 70.9 m 56.5 19.85 4.44 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.36 -174.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 46.17 36.17 3.03 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.069 0.938 . . . . 0.0 110.813 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.753 HG23 ' HB2' ' A' ' 91' ' ' SER . 10.7 t -68.07 104.16 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.833 -176.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 70.0 m -74.73 -49.63 20.38 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.37 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HB3' ' HB3' ' A' ' 60' ' ' ALA . 13.0 ttm180 -115.52 138.95 50.51 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.302 0.572 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -132.0 123.5 27.44 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.12 -176.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -147.31 146.75 29.82 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -176.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.47 131.81 39.25 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.213 174.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 107' ' ' PRO . 53.9 tp -63.97 128.2 34.77 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -173.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -91.96 112.39 24.3 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.679 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.8 mt -94.75 160.61 14.53 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.625 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -102.91 -171.44 1.95 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 111.605 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.01 15.4 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -111.55 -13.18 13.86 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 99.46 14.06 36.47 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.236 -0.507 . . . . 0.0 113.656 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 61.7 t -99.57 124.72 43.37 Favored Pre-proline 0 CA--C 1.541 0.625 0 O-C-N 122.647 -0.326 . . . . 0.0 111.279 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.87 ' HG2' ' HB1' ' A' ' 46' ' ' ALA . 53.0 Cg_exo -55.71 114.85 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.862 2.374 . . . . 0.0 113.177 177.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -75.61 84.9 2.65 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.347 0.594 . . . . 0.0 112.163 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 42' ' ' ALA . 4.3 mp -81.7 -11.55 59.0 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.52 174.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -54.79 -33.15 55.58 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.822 176.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.93 -27.73 63.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.15 0.5 . . . . 0.0 110.935 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -79.16 -44.86 21.09 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.235 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.6 mt -78.01 162.29 26.85 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.595 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.5 100.53 2.75 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -177.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.14 127.92 34.19 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.876 174.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.887 0.375 . . . . 0.0 111.427 -179.656 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.9 mtt . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.8 p -88.2 177.52 6.87 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.894 0.378 . . . . 0.0 111.53 178.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.07 134.58 38.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.85 0.357 . . . . 0.0 111.675 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.482 HG23 ' HB2' ' A' ' 63' ' ' ALA . 22.5 pt -116.39 143.65 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.811 174.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 59' ' ' LEU . 58.1 m-85 -126.24 135.63 51.82 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.965 0.412 . . . . 0.0 112.061 -175.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -134.44 115.01 13.49 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.373 173.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.8 mt -90.56 131.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 120.735 0.302 . . . . 0.0 110.778 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.437 HD23 ' N ' ' A' ' 8' ' ' LEU . 1.9 pt? -147.61 161.2 41.63 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.034 0.445 . . . . 0.0 111.465 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.7 p -69.92 155.66 40.24 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.17 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HB2' ' HB3' ' A' ' 55' ' ' ASN . 38.9 tpt85 -55.61 -33.3 63.85 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.93 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.81 -56.24 21.51 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.904 176.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -52.88 -47.58 67.75 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 121.244 0.545 . . . . 0.0 111.414 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -70.43 -41.35 73.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.313 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -63.99 -52.67 58.51 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 110.735 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.62 -50.76 64.97 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.007 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 22' ' ' PHE . . . -58.46 -43.24 88.79 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.527 177.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 ttmt -61.56 -39.66 91.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.936 0.398 . . . . 0.0 111.257 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.96 -33.59 65.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 176.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -74.97 -24.23 58.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.514 176.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.56 -10.43 61.91 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.523 -176.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -159.08 141.51 13.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.519 . . . . 0.0 112.403 -178.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.564 ' CZ ' HD22 ' A' ' 88' ' ' LEU . 0.6 OUTLIER -120.32 116.09 24.85 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.402 0.62 . . . . 0.0 111.573 173.411 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 87' ' ' PRO . 10.1 pt-20 -76.64 2.47 14.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.891 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 129.32 166.39 11.9 Favored Glycine 0 CA--C 1.522 0.512 0 CA-C-N 116.281 -0.418 . . . . 0.0 112.881 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 51.3 m -75.97 176.5 7.84 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 122.732 -0.275 . . . . 0.0 110.744 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.6 -52.66 63.03 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.035 0.445 . . . . 0.0 111.223 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.52 -50.21 74.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.286 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.433 ' HB3' ' HA ' ' A' ' 34' ' ' ILE . 2.4 m-20 -52.46 -60.53 3.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.95 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.49 -28.15 66.78 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.218 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.45 -46.25 70.32 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -88.45 -32.21 18.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.92 -66.25 0.31 Allowed Glycine 0 CA--C 1.526 0.773 0 C-N-CA 120.17 -1.014 . . . . 0.0 114.513 174.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -111.66 162.44 15.19 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.383 0.611 . . . . 0.0 112.256 -172.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.579 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 61.3 mt -66.78 136.27 27.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.606 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -92.14 120.17 32.48 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.012 0.435 . . . . 0.0 111.794 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.71 ' HB2' ' HB2' ' A' ' 82' ' ' PRO . 67.1 mt -116.83 169.16 9.6 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.183 175.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.0 m -139.56 154.96 47.75 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.081 0.467 . . . . 0.0 111.712 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.23 113.61 25.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.483 -179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.3 -107.09 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 114.343 0.497 . . . . 0.0 114.343 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -50.02 -47.08 53.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.043 0.537 . . . . 0.0 112.439 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -57.25 -25.63 59.47 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.34 -49.07 46.12 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 111.002 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.589 ' HB2' HD11 ' A' ' 109' ' ' LEU . 55.8 tt0 -65.85 -36.76 84.35 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.021 0.439 . . . . 0.0 110.856 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -60.98 -52.61 64.27 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.064 174.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.5 m -57.84 -33.33 68.54 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.807 0.336 . . . . 0.0 111.128 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.03 -54.48 45.47 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.902 0.382 . . . . 0.0 110.87 174.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.17 -30.32 69.26 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.024 0.44 . . . . 0.0 111.978 178.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -76.81 -46.79 23.61 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -110.36 -57.56 2.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.406 0.622 . . . . 0.0 112.385 -174.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.57 ' HB3' HD13 ' A' ' 56' ' ' LEU . 74.6 m-85 -95.2 60.65 2.34 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.423 0.63 . . . . 0.0 111.275 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -73.05 -34.54 66.35 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -174.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 176.91 65.88 0.06 OUTLIER Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.528 -0.844 . . . . 0.0 113.815 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.57 24.63 10.82 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 122.54 -0.388 . . . . 0.0 111.815 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 55.48 120.85 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 10' ' ' ARG . 15.2 m120 64.74 89.44 0.09 Allowed 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.678 0.752 . . . . 0.0 111.809 -176.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 50' ' ' PHE . 58.5 mt -121.24 111.35 17.27 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.779 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.407 ' O ' HD23 ' A' ' 8' ' ' LEU . 55.4 t -84.99 128.88 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 121.329 0.585 . . . . 0.0 112.475 -171.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.519 ' HB2' HD11 ' A' ' 99' ' ' LEU . 66.5 tp -97.06 115.1 26.88 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.239 172.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 83.8 mt -88.89 107.74 19.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 0.0 110.971 176.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.14 100.67 10.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.596 178.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.494 ' HA ' ' OG1' ' A' ' 94' ' ' THR . 48.3 t -114.69 132.35 64.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.722 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.9 92.43 1.26 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 171.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.482 ' HB2' HG23 ' A' ' 4' ' ' ILE . . . -45.06 -66.78 0.35 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -163.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 63' ' ' ALA . 43.8 mm-40 68.69 157.43 0.15 Allowed Pre-proline 0 N--CA 1.473 0.682 0 CA-C-O 121.094 0.473 . . . . 0.0 111.129 -168.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -59.06 -41.34 62.03 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.929 1.752 . . . . 0.0 112.194 171.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.3 mt 70.81 -53.12 0.67 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.946 0.898 . . . . 0.0 111.002 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.17 -77.61 0.05 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.83 175.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -141.93 7.19 1.83 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 123.16 0.584 . . . . 0.0 110.695 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.546 ' OD2' ' HG3' ' A' ' 86' ' ' ARG . 4.7 m-20 -67.95 -52.1 39.91 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -164.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.8 tp -69.27 97.92 0.99 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.712 0.768 . . . . 0.0 111.419 -170.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -99.23 105.15 17.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.222 -177.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -75.06 101.67 4.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.201 0.524 . . . . 0.0 110.639 176.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -70.97 102.44 2.41 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.608 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -108.24 86.09 2.23 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.063 0.459 . . . . 0.0 110.808 175.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -110.54 -150.96 0.47 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.058 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 63.4 mtm180 -67.54 79.34 0.17 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.308 0.575 . . . . 0.0 110.854 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 174.47 160.23 22.23 Favored Glycine 0 CA--C 1.525 0.694 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.711 -178.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.87 -34.33 21.92 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.699 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -83.37 132.5 34.99 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 122.433 -0.451 . . . . 0.0 112.055 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -89.42 116.59 27.72 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.828 0.347 . . . . 0.0 110.773 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -98.99 112.33 62.72 Favored Pre-proline 0 N--CA 1.472 0.666 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -176.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.71 ' HB2' ' HB2' ' A' ' 36' ' ' LEU . 17.6 Cg_exo -66.41 135.5 39.77 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.528 2.152 . . . . 0.0 113.404 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -121.44 154.45 36.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.475 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.579 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 23.8 tp -123.09 140.81 52.64 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.568 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -82.17 -62.46 1.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.546 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 13.0 mtm-85 -71.87 155.76 91.73 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -174.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HA ' ' HA ' ' A' ' 23' ' ' GLU . 51.9 Cg_exo -56.76 115.8 2.74 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.313 2.009 . . . . 0.0 111.516 168.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' A' ' 22' ' ' PHE . 2.5 tt -64.83 116.6 6.49 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 111.715 -171.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.1 mt -78.64 128.96 34.19 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.049 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.52 -33.76 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-O 120.764 0.316 . . . . 0.0 111.483 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 63.7 p -65.46 -28.09 68.97 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.847 0.356 . . . . 0.0 111.603 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.57 -20.11 58.84 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.8 t -71.03 119.42 17.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.949 175.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.494 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 57.0 p -74.93 -63.7 1.2 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -120.45 142.86 48.86 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.613 0.72 . . . . 0.0 112.914 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -132.55 148.59 52.38 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.32 176.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.53 138.79 15.68 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -84.14 127.57 34.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.89 0.376 . . . . 0.0 110.389 177.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 58' ' ' LEU . 94.6 mt -91.62 119.26 31.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.122 0.487 . . . . 0.0 112.223 -176.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.58 154.5 23.75 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.02 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 107' ' ' PRO . 3.3 pp -150.07 149.81 30.84 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.201 0.525 . . . . 0.0 112.183 -176.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -100.48 -172.53 2.22 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.631 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.4 7.84 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.04 -10.74 52.3 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.242 0.544 . . . . 0.0 110.204 177.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.5 36.6 58.88 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.79 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 72.5 t -139.44 116.96 8.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.439 ' HA ' ' HB3' ' A' ' 101' ' ' LEU . 36.5 Cg_endo -66.52 98.85 0.41 Allowed 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 121.951 1.767 . . . . 0.0 110.681 167.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -74.84 84.35 2.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.6 0.714 . . . . 0.0 112.44 -169.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.589 HD11 ' HB2' ' A' ' 43' ' ' GLN . 2.2 pp -96.08 5.68 50.57 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.821 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.55 -24.44 56.53 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.436 -0.412 . . . . 0.0 113.639 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -77.56 -11.39 59.85 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.147 0.499 . . . . 0.0 111.353 174.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -98.98 -47.64 5.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.179 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.72 166.66 11.38 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -176.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 57.59 93.52 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.335 0.588 . . . . 0.0 111.5 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.5 tp -90.58 137.07 32.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.11 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 121.029 0.442 . . . . 0.0 110.872 174.025 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.0 p -79.17 154.6 29.16 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.894 0.378 . . . . 0.0 111.025 175.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.1 mt -112.96 130.95 55.94 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.962 0.41 . . . . 0.0 111.66 -177.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 70' ' ' LEU . 24.0 pt -105.01 146.17 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.723 174.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.453 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 44.1 m-85 -129.85 164.23 24.58 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.247 0.546 . . . . 0.0 112.148 -172.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' HE2' ' HG ' ' A' ' 36' ' ' LEU . 24.5 ttmm -156.52 106.76 2.34 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.809 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 58.1 mt -88.89 135.9 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.945 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.448 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.0 pt? -152.24 166.93 30.23 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 120.952 0.406 . . . . 0.0 111.305 -177.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.3 t -75.68 150.48 37.9 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.858 0.361 . . . . 0.0 111.096 176.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.545 ' HB2' ' HB2' ' A' ' 55' ' ' ASN . 8.7 tpt180 -56.82 -35.67 69.05 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.043 0.449 . . . . 0.0 110.839 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.71 -37.47 73.57 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.373 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -75.88 -38.84 57.47 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.122 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -69.15 -48.43 62.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.33 -37.67 84.13 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.207 -0.308 . . . . 0.0 111.587 175.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 19' ' ' GLN . . . -59.47 -45.29 92.05 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.064 0.459 . . . . 0.0 110.648 174.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.7 -53.02 62.94 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.563 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mtmp? -61.84 -27.57 68.87 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.887 0.375 . . . . 0.0 111.66 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.63 -51.36 51.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.957 0.408 . . . . 0.0 111.403 176.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 12.6 pt20 -87.88 3.27 49.08 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 177.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.85 -1.01 48.79 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 121.502 -0.38 . . . . 0.0 114.034 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -149.14 149.21 30.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 122.406 -0.467 . . . . 0.0 111.513 -178.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -110.42 132.87 53.8 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.46 0.648 . . . . 0.0 111.872 178.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -106.61 130.57 54.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.087 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -47.75 -71.28 0.58 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 114.52 0.568 . . . . 0.0 114.52 -173.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 28' ' ' ASP . 44.3 t 179.4 159.34 0.68 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.713 0.405 . . . . 0.0 110.143 -178.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -55.19 35.45 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.717 0.294 . . . . 0.0 111.292 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.3 p -63.15 -33.32 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 111.813 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.576 ' HB2' ' HB3' ' A' ' 25' ' ' SER . 22.1 t0 -62.1 -58.44 7.82 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.251 0.548 . . . . 0.0 110.481 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.97 -33.83 76.61 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.04 -37.95 89.31 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 178.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -75.99 -34.57 59.75 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.755 0.312 . . . . 0.0 110.771 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 165.12 -68.86 0.2 Allowed Glycine 0 CA--C 1.527 0.813 0 C-N-CA 120.151 -1.023 . . . . 0.0 114.566 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.576 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 52.9 m-85 -145.45 141.84 28.73 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 122.42 -0.459 . . . . 0.0 111.738 -167.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 62.1 mt -50.96 107.09 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -174.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -80.53 127.93 33.01 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.281 0.562 . . . . 0.0 111.474 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.52 ' HG ' ' HE2' ' A' ' 6' ' ' LYS . 7.3 mp -91.32 -46.33 8.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.5 m 66.5 97.06 0.05 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 121.158 0.504 . . . . 0.0 110.973 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.52 155.92 19.1 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.74 -119.92 18.92 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.721 -0.672 . . . . 0.0 113.939 174.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.404 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 5.7 mp0 -59.74 -40.0 86.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.118 0.485 . . . . 0.0 110.994 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -67.39 -29.13 68.56 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.141 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.19 -50.87 59.39 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.138 0.494 . . . . 0.0 110.895 176.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.427 HE21 HD11 ' A' ' 109' ' ' LEU . 5.4 tp-100 -57.41 -47.52 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.251 175.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.539 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 33.1 tt0 -61.35 -48.36 81.64 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.302 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -60.82 -37.86 83.43 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 120.952 0.405 . . . . 0.0 111.162 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.413 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.43 -40.84 83.61 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.74 175.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.12 -25.62 61.8 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.319 -0.4 . . . . 0.0 112.024 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.539 ' HG3' ' O ' ' A' ' 44' ' ' GLU . 65.1 mttm -74.78 -69.43 0.46 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.39 0.614 . . . . 0.0 111.669 177.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.3 m0 -75.0 -60.68 2.18 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.503 -0.771 . . . . 0.0 112.4 -170.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.541 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 45.0 m-85 -82.92 -66.33 0.9 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.575 -170.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 70.81 -65.54 0.33 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 172.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -151.48 56.19 0.45 Allowed Glycine 0 CA--C 1.526 0.759 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.57 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.627 ' HB2' HD21 ' A' ' 56' ' ' LEU . 78.6 mt-30 -99.81 -164.66 1.14 Allowed 'General case' 0 CA--C 1.539 0.544 0 O-C-N 122.774 -0.251 . . . . 0.0 110.834 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -102.67 -67.19 0.89 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.545 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 15.4 p-10 -97.33 67.7 2.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.857 0.837 . . . . 0.0 111.728 -168.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.627 HD21 ' HB2' ' A' ' 53' ' ' GLN . 37.7 mt -94.71 124.78 38.95 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.542 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 t -110.65 148.64 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.26 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.0 tt -122.27 118.77 29.33 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.824 0.345 . . . . 0.0 110.799 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.6 mt -90.85 131.56 36.41 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.56 175.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -128.53 125.08 37.59 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.904 0.383 . . . . 0.0 111.519 -178.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.99 134.5 57.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 120.869 0.366 . . . . 0.0 111.128 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -74.53 138.4 43.09 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 175.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.416 ' O ' ' HG ' ' A' ' 66' ' ' LEU . . . -48.39 -70.51 0.09 Allowed 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -176.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.496 ' HB3' ' HD2' ' A' ' 65' ' ' PRO . 28.2 mt-10 61.24 167.98 0.09 OUTLIER Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.496 ' HD2' ' HB3' ' A' ' 64' ' ' GLU . 82.8 Cg_exo -52.24 5.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.503 0 C-N-CA 123.711 2.941 . . . . 0.0 116.356 176.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 63' ' ' ALA . 4.3 pp -88.35 10.34 20.23 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.315 -0.865 . . . . 0.0 111.656 178.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -71.83 27.13 0.63 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.504 0.562 . . . . 0.0 114.504 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -100.17 -35.4 9.67 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.23 -0.571 . . . . 0.0 110.247 173.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -78.76 -12.69 60.03 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.13 175.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 4' ' ' ILE . 51.5 tp -114.0 134.19 55.01 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.814 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -137.25 134.57 36.33 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.966 0.413 . . . . 0.0 111.416 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.515 ' HB3' ' HB3' ' A' ' 80' ' ' ARG . 73.0 m95 -83.66 89.41 7.12 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.97 0.414 . . . . 0.0 110.721 177.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.39 117.6 31.2 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.097 0.475 . . . . 0.0 112.131 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.436 ' HB2' ' HG2' ' A' ' 80' ' ' ARG . . . -89.49 114.12 25.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.037 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.3 m -117.78 36.24 4.38 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -164.26 -36.38 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 0.0 111.657 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 141.17 100.58 0.42 Allowed Glycine 0 CA--C 1.526 0.723 0 C-N-CA 121.182 -0.533 . . . . 0.0 113.038 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.8 -47.05 3.72 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.216 -0.516 . . . . 0.0 113.581 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.18 104.45 1.82 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 122.414 -0.463 . . . . 0.0 111.484 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.515 ' HB3' ' HB3' ' A' ' 72' ' ' TRP . 50.4 mtm180 -92.9 107.82 19.52 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.962 0.411 . . . . 0.0 111.365 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -84.31 114.68 56.25 Favored Pre-proline 0 CA--C 1.541 0.634 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.408 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.51 111.45 1.66 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.406 2.071 . . . . 0.0 112.245 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.576 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 57.8 m170 -106.6 133.93 50.52 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.589 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.8 tp -100.22 120.42 39.87 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.924 0.392 . . . . 0.0 110.293 177.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -79.52 7.09 8.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -174.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -145.43 155.43 53.64 Favored Pre-proline 0 CA--C 1.543 0.674 0 O-C-N 122.357 -0.214 . . . . 0.0 111.116 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -53.31 135.75 61.06 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 122.683 2.256 . . . . 0.0 113.072 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 61.5 tp -80.49 88.72 5.62 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.053 0.454 . . . . 0.0 111.232 -176.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 68.2 mt -61.36 141.84 57.33 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 122.282 -0.261 . . . . 0.0 110.532 176.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 87.9 t -58.17 -27.45 32.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.05 0.453 . . . . 0.0 111.138 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.2 t -65.69 -23.7 66.83 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 176.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.36 -21.12 53.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.782 0.325 . . . . 0.0 111.536 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.8 t -76.73 87.86 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.05 0.453 . . . . 0.0 110.929 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.529 HG22 ' HG3' ' A' ' 95' ' ' ARG . 97.8 m -59.87 -48.55 81.23 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.115 -178.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.529 ' HG3' HG22 ' A' ' 94' ' ' THR . 69.2 mtm180 -134.12 148.13 50.94 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.633 0.254 . . . . 0.0 111.345 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -157.74 153.33 26.4 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.749 0.309 . . . . 0.0 111.609 177.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -169.18 151.26 4.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -73.14 126.31 29.73 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 174.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.7 pp -78.74 174.83 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -170.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' HA ' ' A' ' 107' ' ' PRO . 23.4 t70 -107.91 129.16 55.11 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.616 -177.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.581 HD21 HD12 ' A' ' 56' ' ' LEU . 80.9 mt -96.56 152.06 18.99 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.993 0.425 . . . . 0.0 111.91 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.658 ' HB2' ' HG2' ' A' ' 108' ' ' GLN . 28.1 t70 -86.3 174.71 8.88 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.92 177.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.33 65.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -96.27 9.42 41.14 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.139 0.495 . . . . 0.0 111.052 176.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.503 ' O ' HD22 ' A' ' 101' ' ' LEU . . . 93.52 -33.98 4.86 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 121.243 -0.503 . . . . 0.0 113.658 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.8 t -54.41 122.82 40.13 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.436 ' HA ' ' O ' ' A' ' 100' ' ' ASP . 31.2 Cg_exo -59.84 103.97 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 112.264 176.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.658 ' HG2' ' HB2' ' A' ' 102' ' ' ASP . 83.6 mm-40 -76.55 68.36 2.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.444 0.64 . . . . 0.0 111.77 -177.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 112' ' ' HIS . 2.3 pp -100.32 5.39 44.47 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.538 176.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -56.93 -49.3 72.26 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.482 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.16 -19.62 62.4 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.215 0.531 . . . . 0.0 111.079 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . 0.455 ' HB3' ' O ' ' A' ' 109' ' ' LEU . 73.3 t60 -76.73 -30.1 56.48 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.349 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.443 HD22 ' CZ ' ' A' ' 5' ' ' TYR . 30.5 mt -104.03 -149.38 0.41 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.131 -179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.02 118.36 6.65 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.931 0.396 . . . . 0.0 111.997 -178.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.544 ' O ' HD23 ' A' ' 115' ' ' LEU . 9.8 tt -85.04 -7.71 59.01 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.19 0.519 . . . . 0.0 110.696 178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 . . . . . 0 N--CA 1.474 0.738 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.109 -179.313 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.541 ' O ' HG23 ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.624 0.249 . . . . 0.0 110.622 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.541 HG23 ' O ' ' A' ' 1' ' ' MET . 0.8 OUTLIER -171.05 80.04 0.08 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.435 0.694 . . . . 0.0 110.752 -178.57 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.8 mt -87.8 113.77 23.78 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -174.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.566 HD12 HD22 ' A' ' 36' ' ' LEU . 25.7 pt -98.51 141.79 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 170.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.511 ' HB3' HD11 ' A' ' 58' ' ' LEU . 92.2 m-85 -117.38 147.4 42.68 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.657 ' HE2' ' HE2' ' A' ' 22' ' ' PHE . 77.7 tttt -151.93 118.1 5.56 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.261 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.534 ' N ' HD12 ' A' ' 7' ' ' ILE . 3.3 mp -93.19 149.57 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-O 120.96 0.41 . . . . 0.0 111.678 -176.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 8' ' ' LEU . 2.3 pt? -160.27 171.44 19.16 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.99 174.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -79.89 145.65 32.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.86 0.362 . . . . 0.0 111.148 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -58.43 -29.99 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.524 179.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.03 -59.48 5.29 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.381 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -60.86 -34.31 74.4 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.823 0.344 . . . . 0.0 111.639 177.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 24.7 t-105 -64.32 -47.73 78.3 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.912 0.387 . . . . 0.0 111.869 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.23 -40.12 86.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.464 0.65 . . . . 0.0 110.125 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.07 -34.68 72.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.027 174.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.91 97.94 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 174.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -61.54 -35.83 78.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.294 176.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.17 -27.43 63.82 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.925 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -109.28 -0.78 18.98 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.011 0.434 . . . . 0.0 111.61 176.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.13 -0.53 46.46 Favored Glycine 0 CA--C 1.53 1.013 0 N-CA-C 114.51 0.564 . . . . 0.0 114.51 176.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -136.16 155.27 50.39 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.948 -0.737 . . . . 0.0 111.582 -175.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.657 ' HE2' ' HE2' ' A' ' 6' ' ' LYS . 44.1 t80 -128.95 160.8 31.54 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.072 172.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.557 ' HB3' HD13 ' A' ' 34' ' ' ILE . 67.1 mt-10 73.96 -168.39 0.11 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.599 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.21 22.44 70.88 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.304 -173.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.3 t -88.39 -177.23 5.59 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.896 0.478 . . . . 0.0 111.573 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -48.43 -42.49 32.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.1 t -56.79 -39.61 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 120.903 0.382 . . . . 0.0 111.717 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -67.34 -50.83 58.34 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.088 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.88 -27.26 68.08 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.79 0.329 . . . . 0.0 111.688 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.44 -56.03 4.89 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.069 0.461 . . . . 0.0 112.039 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -80.49 -29.71 37.35 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 118.25 -27.42 7.35 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.975 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -152.08 166.5 31.42 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.212 0.529 . . . . 0.0 111.597 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.557 HD13 ' HB3' ' A' ' 23' ' ' GLU . 50.4 mt -80.18 149.44 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.798 -178.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -111.86 121.19 44.36 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.348 -0.387 . . . . 0.0 112.007 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.622 ' HG ' ' HD2' ' A' ' 6' ' ' LYS . 6.2 mp -119.28 -175.42 2.93 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 171.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.9 m -146.71 153.4 40.21 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.05 -166.83 1.7 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.824 174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.8 -69.99 1.11 Allowed Glycine 0 CA--C 1.529 0.946 0 N-CA-C 114.138 0.415 . . . . 0.0 114.138 -175.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.18 88.25 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.922 0.392 . . . . 0.0 111.59 -177.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -61.34 -46.24 91.06 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.489 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HB1' HD11 ' A' ' 7' ' ' ILE . . . -62.07 -42.59 99.36 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.742 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -59.9 -48.72 80.55 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 120.989 0.424 . . . . 0.0 111.555 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -73.12 -41.29 64.16 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.4 m -59.5 -42.0 91.16 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.973 0.416 . . . . 0.0 111.104 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.444 ' HB1' ' HG2' ' A' ' 107' ' ' PRO . . . -58.87 -42.49 89.55 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.063 176.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.21 68.79 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -82.44 -63.22 1.42 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.07 0.462 . . . . 0.0 112.058 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -74.31 -40.13 62.44 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -172.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -117.02 34.45 5.1 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.128 0.489 . . . . 0.0 110.907 -175.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 51' ' ' ARG . 2.9 ptm180 -36.06 -52.7 0.77 Allowed 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -176.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.633 ' HA2' HD11 ' A' ' 101' ' ' LEU . . . -156.29 47.25 0.49 Allowed Glycine 0 CA--C 1.522 0.524 0 C-N-CA 120.858 -0.687 . . . . 0.0 113.495 -176.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.581 ' HB2' HD21 ' A' ' 56' ' ' LEU . 64.2 mt-30 -87.5 158.5 18.92 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.722 0.296 . . . . 0.0 110.893 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.38 128.89 34.99 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 67.56 84.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.828 175.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.581 HD21 ' HB2' ' A' ' 53' ' ' GLN . 96.1 mt -112.69 129.83 56.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.531 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.419 ' O ' HD23 ' A' ' 8' ' ' LEU . 60.3 t -102.64 130.79 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.057 0.456 . . . . 0.0 111.439 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 60.6 tp -99.44 104.03 15.85 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 175.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.427 HD22 HG11 ' A' ' 93' ' ' VAL . 82.7 mt -76.29 109.81 10.29 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.075 0.464 . . . . 0.0 111.376 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.474 ' O ' ' HB ' ' A' ' 94' ' ' THR . . . -101.12 115.84 31.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.41 175.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 4' ' ' ILE . 51.8 t -126.24 131.86 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.636 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 18.6 tt0 -92.22 105.28 17.53 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.17 0.509 . . . . 0.0 111.985 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.58 84.85 7.06 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.425 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.595 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 41.2 mt-10 -80.58 -44.8 1.32 Allowed Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 178.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.595 ' HD2' ' N ' ' A' ' 64' ' ' GLU . 10.9 Cg_endo -53.9 -62.27 0.33 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.828 1.685 . . . . 0.0 112.294 177.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 70' ' ' LEU . 18.6 tp 57.13 22.92 7.97 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.23 0.538 . . . . 0.0 111.985 172.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -93.77 -83.31 1.57 Allowed Glycine 0 CA--C 1.522 0.498 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.501 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -102.34 5.56 39.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.029 0.442 . . . . 0.0 111.167 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.516 ' O ' HD12 ' A' ' 84' ' ' LEU . 4.0 p-10 -92.79 -64.17 1.13 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.182 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.58 ' HB3' HD12 ' A' ' 66' ' ' LEU . 42.0 tp -107.89 147.7 30.62 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.916 0.388 . . . . 0.0 111.09 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -136.63 101.04 4.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.006 0.432 . . . . 0.0 111.94 -174.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -70.28 119.82 15.03 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.762 177.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -158.32 144.63 17.27 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.602 -172.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.46 ' HB2' ' HA ' ' A' ' 80' ' ' ARG . . . -149.51 158.1 43.87 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.251 0.548 . . . . 0.0 112.407 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.6 m -154.78 126.74 7.64 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.176 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 76' ' ' ARG . 3.8 mpt_? 69.83 -59.99 0.49 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 176.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.2 -15.38 44.16 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 114.352 0.501 . . . . 0.0 114.352 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 79.2 -45.07 2.74 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.608 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.81 134.86 57.51 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.931 0.396 . . . . 0.0 112.047 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.46 ' HA ' ' HB2' ' A' ' 74' ' ' ALA . 83.6 mtt180 -79.1 110.89 14.77 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.153 -177.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 80.2 m-85 -95.17 117.64 66.69 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-O 120.756 0.313 . . . . 0.0 111.712 -177.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 81' ' ' PHE . 18.5 Cg_exo -66.82 102.19 0.61 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.661 2.24 . . . . 0.0 112.374 175.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -90.94 115.4 27.94 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.133 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.516 HD12 ' O ' ' A' ' 69' ' ' ASP . 55.2 tp -105.24 130.57 53.36 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.707 0.289 . . . . 0.0 110.543 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -110.32 37.11 2.82 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 20.5 ptp180 -167.55 138.42 2.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 O-C-N 122.452 -0.155 . . . . 0.0 110.986 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 26.8 Cg_exo -62.48 149.33 91.31 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 122.721 2.281 . . . . 0.0 113.046 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -108.99 118.56 37.11 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.33 0.586 . . . . 0.0 111.282 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -71.04 135.56 47.84 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.058 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 30.0 m -57.88 -35.24 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -172.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 t -72.54 -3.77 26.56 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.729 0.3 . . . . 0.0 111.722 -179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -98.01 -11.86 22.55 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.808 0.337 . . . . 0.0 111.77 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.427 HG11 HD22 ' A' ' 59' ' ' LEU . 57.6 t -66.61 124.81 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 O-C-N 122.319 -0.238 . . . . 0.0 111.407 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' A' ' 60' ' ' ALA . 40.8 m -59.72 -38.83 82.74 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.768 0.318 . . . . 0.0 111.645 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -160.85 143.13 12.55 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.301 0.572 . . . . 0.0 112.231 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.3 pt-20 -106.7 84.07 1.95 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.489 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.52 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -74.6 84.31 2.06 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.216 0.532 . . . . 0.0 112.209 -175.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 102.22 1.59 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.573 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 pp -116.15 168.37 10.17 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -122.87 176.12 6.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.521 177.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.633 HD11 ' HA2' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -158.74 179.07 9.44 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.816 -179.221 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -113.87 170.28 8.38 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.478 0.656 . . . . 0.0 112.127 170.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.75 94.02 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.366 -178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 26.3 t70 91.25 -6.58 0.26 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.791 0.836 . . . . 0.0 109.678 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -60.19 -39.89 96.54 Favored Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 164.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.501 ' HA ' HD13 ' A' ' 101' ' ' LEU . 1.3 t 67.13 141.14 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 123.951 0.442 . . . . 0.0 112.153 169.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.558 ' HD3' HD13 ' A' ' 101' ' ' LEU . 53.2 Cg_exo -35.01 101.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 123.138 2.559 . . . . 0.0 113.888 -173.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -70.4 80.22 0.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -175.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.567 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 8.4 mp -79.39 -23.56 43.2 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.307 -0.406 . . . . 0.0 112.072 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -48.59 -41.5 26.17 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.635 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -78.05 -13.67 59.79 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -95.58 -13.12 24.67 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.615 0.245 . . . . 0.0 111.173 179.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 109' ' ' LEU . 42.7 mt -110.33 162.66 14.42 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 65.94 -72.05 0.08 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 170.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 52.2 tp -87.88 152.3 22.19 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.4 0.619 . . . . 0.0 112.519 -171.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 . . . . . 0 CA--C 1.538 0.494 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.864 175.795 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.9 mmt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.219 0.533 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 53.3 p -79.14 29.38 0.22 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -177.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.7 mt -81.98 105.96 13.51 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.987 -0.446 . . . . 0.0 111.406 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.44 ' CG2' ' HB3' ' A' ' 36' ' ' LEU . 13.6 mt -92.35 142.92 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.19 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -130.72 119.42 22.33 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.664 0.269 . . . . 0.0 111.609 -177.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 35' ' ' HIS . 33.8 ttpt -127.24 123.06 35.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.651 0.262 . . . . 0.0 111.673 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.479 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.1 mp -91.69 138.14 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.034 0.445 . . . . 0.0 111.725 -178.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.42 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.8 pt? -149.69 174.54 12.46 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.189 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.413 ' OG ' ' HG2' ' A' ' 12' ' ' GLU . 83.9 p -82.48 151.97 26.28 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.943 -0.473 . . . . 0.0 111.063 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.27 -30.06 64.37 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.832 0.348 . . . . 0.0 110.497 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.37 39.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.26 175.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HG2' ' OG ' ' A' ' 9' ' ' SER . 12.3 mm-40 -58.29 -43.55 88.11 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 111.144 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.52 ' CH2' HG13 ' A' ' 90' ' ' VAL . 28.4 t-105 -62.74 -51.74 65.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.678 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.56 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 12.4 t70 -59.44 -47.42 85.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.327 0.584 . . . . 0.0 110.784 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.41 -46.71 76.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.467 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.72 74.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.56 ' HE3' ' HA ' ' A' ' 14' ' ' ASP . 10.4 mtmp? -65.71 -27.92 68.68 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.683 0.278 . . . . 0.0 110.958 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.27 83.68 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.135 0.493 . . . . 0.0 111.091 173.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -80.23 -26.53 39.04 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.235 0.541 . . . . 0.0 110.856 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.06 -10.77 51.87 Favored Glycine 0 CA--C 1.526 0.754 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.447 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HG2' HD13 ' A' ' 89' ' ' LEU . 24.8 mtt-85 -135.73 121.68 19.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.59 -0.359 . . . . 0.0 110.821 -178.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -78.6 86.67 4.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 172.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.11 80.27 9.24 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.194 0.521 . . . . 0.0 112.089 -174.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.67 -135.35 48.68 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 115.58 -0.737 . . . . 0.0 114.565 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.494 ' O ' ' HB3' ' A' ' 28' ' ' ASP . 46.5 t 170.42 177.48 0.05 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.627 0.771 . . . . 0.0 110.25 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.41 -49.12 77.24 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 122.003 -0.436 . . . . 0.0 111.865 -179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.493 HG22 ' NE2' ' A' ' 35' ' ' HIS . 10.7 p -65.33 -24.52 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 111.597 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.494 ' HB3' ' O ' ' A' ' 25' ' ' SER . 0.3 OUTLIER -64.12 -53.66 46.16 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.758 175.094 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.27 -30.61 68.42 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 120.621 0.248 . . . . 0.0 111.082 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.17 77.92 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.868 0.366 . . . . 0.0 111.709 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.51 ' HB3' ' CD1' ' A' ' 33' ' ' PHE . 3.5 m-20 -87.91 -29.67 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.103 0.477 . . . . 0.0 111.566 173.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.18 -6.67 81.28 Favored Glycine 0 CA--C 1.528 0.9 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.902 -170.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.608 ' HB2' ' HB3' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -151.45 143.81 24.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.225 0.61 . . . . 0.0 111.092 -177.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mt -60.53 130.42 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -168.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.493 ' NE2' HG22 ' A' ' 27' ' ' VAL . 33.7 m-70 -72.45 140.12 48.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.736 170.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB3' ' CG2' ' A' ' 4' ' ' ILE . 3.4 mp -145.61 -64.51 0.32 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.68 0.276 . . . . 0.0 110.714 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 56.2 m 78.71 160.29 0.19 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.81 177.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -97.72 177.58 5.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.864 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -41.86 -47.97 5.13 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 114.677 0.631 . . . . 0.0 114.677 -175.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -54.61 -69.02 0.14 Allowed 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.426 0.631 . . . . 0.0 111.781 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.548 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 22.2 mp0 -68.91 -20.09 64.22 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.888 -175.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.96 -56.52 8.71 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.698 0.285 . . . . 0.0 111.358 178.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.461 ' NE2' ' HA ' ' A' ' 108' ' ' GLN . 29.3 tt0 -61.74 -39.82 92.92 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 111.728 0.269 . . . . 0.0 111.728 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -58.97 -56.4 22.75 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.979 0.419 . . . . 0.0 110.935 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.5 m -56.02 -34.02 65.44 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.122 176.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.54 -49.42 73.55 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.624 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.24 -33.07 74.69 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.054 0.454 . . . . 0.0 111.911 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -77.05 -53.03 8.31 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.36 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 12.1 m95 -88.79 -42.26 12.02 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -174.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -112.74 57.12 0.66 Allowed 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.169 0.509 . . . . 0.0 110.713 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -4.54 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -172.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.88 73.63 0.02 OUTLIER Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.372 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.573 ' HB2' HD21 ' A' ' 56' ' ' LEU . 88.0 mt-30 -107.3 26.0 10.73 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 121.452 0.644 . . . . 0.0 110.996 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . 64.46 -78.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -83.49 63.22 7.22 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.576 0.703 . . . . 0.0 111.367 -172.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.693 HD12 HD21 ' A' ' 101' ' ' LEU . 52.2 mt -88.5 138.92 31.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.606 177.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' HD23 ' A' ' 8' ' ' LEU . 59.7 t -123.51 141.92 42.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.648 178.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 97' ' ' ALA . 8.8 tt -109.38 115.4 29.88 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.899 0.38 . . . . 0.0 110.615 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.1 108.59 13.82 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.87 0.366 . . . . 0.0 111.317 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.04 110.38 22.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.5 t -120.01 116.68 51.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.45 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.445 ' HG2' ' OG1' ' A' ' 94' ' ' THR . 11.8 pt-20 -79.41 103.38 9.29 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.594 0.711 . . . . 0.0 110.902 176.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.458 ' HB3' ' HB ' ' A' ' 2' ' ' THR . . . -77.16 40.62 0.27 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.142 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -75.85 -45.89 3.98 Favored Pre-proline 0 CA--C 1.548 0.888 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.825 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -83.75 -157.23 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 122.216 1.944 . . . . 0.0 112.374 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 69' ' ' ASP . 90.5 mt 67.83 -55.38 0.49 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.366 1.066 . . . . 0.0 112.072 -177.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.08 -102.94 1.3 Allowed Glycine 0 CA--C 1.528 0.906 0 CA-C-N 116.213 -0.449 . . . . 0.0 113.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -69.82 -13.92 62.5 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -172.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 66' ' ' LEU . 58.1 m-20 -67.27 -17.62 64.87 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.5 tp -123.33 149.88 44.32 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.456 ' NZ ' ' OH ' ' A' ' 85' ' ' TYR . 8.1 ttpm? -149.25 128.36 12.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.925 0.393 . . . . 0.0 111.308 171.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.416 ' HA ' ' HA ' ' A' ' 82' ' ' PRO . 53.4 m95 -72.55 86.79 1.19 Allowed 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -86.17 128.89 34.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.961 -169.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.586 ' HB2' HH11 ' A' ' 80' ' ' ARG . . . -76.58 152.01 36.09 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.482 0.658 . . . . 0.0 112.729 -176.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.0 t -130.93 -178.64 4.9 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.0 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.7 tpt180 -55.44 103.45 0.09 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.913 0.485 . . . . 0.0 111.682 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.25 -16.62 5.7 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.473 -0.394 . . . . 0.0 112.916 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.45 -2.64 59.18 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.172 -0.537 . . . . 0.0 113.324 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.51 140.35 57.99 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.704 -0.292 . . . . 0.0 111.757 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.586 HH11 ' HB2' ' A' ' 74' ' ' ALA . 24.9 mmm180 -102.66 111.91 24.44 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.734 0.302 . . . . 0.0 111.262 -177.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -107.45 114.15 61.06 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-O 120.637 0.256 . . . . 0.0 111.364 179.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 37' ' ' SER . 43.6 Cg_endo -67.37 103.09 0.75 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.35 2.034 . . . . 0.0 112.819 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.608 ' HB3' ' HB2' ' A' ' 33' ' ' PHE . 31.3 m80 -98.91 129.82 45.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.928 176.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.43 ' HG ' ' H ' ' A' ' 86' ' ' ARG . 36.3 tp -95.07 137.26 34.37 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.456 ' OH ' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 m-85 -105.61 12.91 30.65 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -173.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.43 ' H ' ' HG ' ' A' ' 84' ' ' LEU . 44.4 mtm180 -141.67 154.44 66.14 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 122.664 0.386 . . . . 0.0 110.695 173.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.6 132.63 52.96 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.532 2.155 . . . . 0.0 113.105 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.6 tp -79.3 105.45 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.863 0.363 . . . . 0.0 111.707 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.427 HD13 ' HG2' ' A' ' 21' ' ' ARG . 3.7 mm? -63.98 123.53 19.24 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.238 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.52 HG13 ' CH2' ' A' ' 13' ' ' TRP . 76.3 t -56.2 -39.44 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 120.955 0.407 . . . . 0.0 111.815 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.6 t -72.96 -4.53 32.74 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -99.56 -11.49 20.96 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 120.998 0.428 . . . . 0.0 111.378 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -69.25 135.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-O 120.933 0.397 . . . . 0.0 111.706 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.445 ' OG1' ' HG2' ' A' ' 62' ' ' GLU . 61.3 m -65.15 -50.0 67.67 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.064 0.459 . . . . 0.0 111.597 -179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -155.31 143.09 19.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.284 0.564 . . . . 0.0 111.671 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 96' ' ' GLU . 10.4 pt-20 -97.15 86.49 3.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.335 171.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.486 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . . . -75.98 86.45 2.9 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -171.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -66.81 139.28 57.77 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.306 -0.406 . . . . 0.0 109.924 172.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.455 HD23 ' N ' ' A' ' 99' ' ' LEU . 2.0 pt? -141.2 145.11 35.21 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.143 0.497 . . . . 0.0 112.088 -177.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -88.63 131.82 34.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.395 172.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.693 HD21 HD12 ' A' ' 56' ' ' LEU . 88.4 mt -71.14 149.84 46.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.119 0.485 . . . . 0.0 112.119 -176.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.82 166.15 3.55 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.639 175.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.76 -25.84 66.8 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.126 0.489 . . . . 0.0 111.7 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -83.41 -10.93 58.11 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.501 0.667 . . . . 0.0 110.078 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.01 29.94 18.89 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.695 -0.684 . . . . 0.0 113.008 -178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 73.4 t -103.91 123.43 41.07 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 83.04 1.04 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 170.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.461 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 2.8 pt20 -80.25 115.37 19.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.433 0.635 . . . . 0.0 112.227 -174.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -88.63 -29.92 19.59 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -47.24 -46.12 21.41 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.414 -0.422 . . . . 0.0 113.556 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -64.93 -40.29 94.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.858 0.361 . . . . 0.0 111.575 177.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -79.02 -24.17 43.86 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -174.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 46.6 mt -93.69 -101.6 0.14 Allowed 'General case' 0 CA--C 1.542 0.658 0 O-C-N 122.321 -0.237 . . . . 0.0 111.287 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . 67.76 -33.53 0.22 Allowed 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 176.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.1 mt 57.7 25.11 11.39 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.323 0.582 . . . . 0.0 110.81 -172.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.54 0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.154 -177.284 . . . . . . . . 0 0 . 1 stop_ save_