data_1kqh_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 1kqh _Structure_validation_residue.Date_analyzed 2016-10-06 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' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.3 p . . . . . 0 N--CA 1.449 -0.479 0 CA-C-O 120.872 0.368 . . . . 0.0 110.5 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.432 HD11 ' O ' ' A' ' 8' ' ' ASP . 86.4 mt -85.74 130.54 34.53 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.107 -179.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 7' ' ' ALA . . . -78.92 -166.4 0.9 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.112 0.482 . . . . 0.0 112.269 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.524 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.3 pm0 -70.98 134.69 47.36 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.468 0.651 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.18 38.8 10.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.623 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' ALA . . . -106.5 135.92 47.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.638 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.432 ' O ' HD11 ' A' ' 3' ' ' LEU . 10.0 t70 -59.5 139.05 57.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.259 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.429 ' HB3' HD12 ' A' ' 3' ' ' LEU . 1.6 p . . . . . 0 C--N 1.326 -0.446 0 CA-C-O 121.95 0.881 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.404 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.1 m . . . . . 0 N--CA 1.445 -0.694 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.526 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 11.7 m -74.67 140.59 44.32 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 121.126 -0.23 . . . . 0.0 110.456 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.3 m -62.28 147.63 47.47 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -85.58 148.6 49.53 Favored Pre-proline 0 C--N 1.308 -1.213 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.22 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -95.55 32.76 10.65 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.895 -1.71 . . . . 0.0 113.684 1.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.786 ' HD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -75.32 145.5 41.72 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 tp -128.38 140.51 51.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.798 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.2 t -68.29 122.55 18.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.3 p -101.66 124.34 47.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.153 0.501 . . . . 0.0 111.26 -179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.2 m -119.48 66.25 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.549 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.439 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.3 pt -70.85 45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 59.6 21.34 9.94 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.011 0.524 . . . . 0.0 111.932 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 23.8 m-85 -135.32 139.31 44.22 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.53 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 61.1 t80 -90.67 134.95 29.73 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.392 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.53 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 81.0 Cg_endo -98.92 168.74 10.29 Favored 'Cis proline' 0 N--CA 1.454 -0.851 0 C-N-CA 124.348 -1.105 . . . . 0.0 113.159 0.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.0 m -79.49 151.44 30.79 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.48 134.39 16.79 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.385 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 6.9 m -67.41 130.04 41.82 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -119.91 156.07 54.61 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 123.858 0.724 . . . . 0.0 109.844 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.786 ' HA ' ' HD2' ' A' ' 21' ' ' TYR . 19.8 Cg_endo . . . . . 0 N--CA 1.462 -0.359 0 C-N-CA 122.458 2.105 . . . . 0.0 110.477 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 84.9 mt -79.68 126.13 30.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.69 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.55 -159.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.315 0.579 . . . . 0.0 112.503 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.791 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -65.88 127.61 32.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.095 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.53 42.22 11.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.941 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.657 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -107.79 120.7 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.791 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.505 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 58.1 m-20 -58.47 125.88 25.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.581 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 m . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.532 0.206 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.9 m -69.39 142.78 53.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.625 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -66.09 146.23 54.9 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.45 140.43 55.99 Favored Pre-proline 0 C--N 1.31 -1.113 0 C-N-CA 120.689 -0.405 . . . . 0.0 110.361 -179.718 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -102.99 41.66 3.22 Favored 'Cis proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.399 -1.084 . . . . 0.0 113.553 1.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.791 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 1.7 m-85 -71.68 144.0 49.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -117.64 133.73 55.63 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.297 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.5 t -71.06 122.46 20.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.4 p -102.14 126.35 49.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.105 0.478 . . . . 0.0 111.726 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.0 m -114.3 64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.044 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.4 pt -71.21 45.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.67 20.93 10.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.071 0.548 . . . . 0.0 112.243 178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -128.81 135.38 49.06 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 31.6 t80 -91.52 129.98 40.94 Favored Pre-proline 0 C--N 1.316 -0.89 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.944 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.478 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 97.1 Cg_endo -97.18 178.51 7.81 Favored 'Cis proline' 0 N--CA 1.451 -1.013 0 C-N-CA 124.042 -1.232 . . . . 0.0 112.714 -0.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.1 m -79.62 149.89 31.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 1.4 p -138.96 135.63 34.56 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.49 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.0 m -67.0 127.08 31.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.503 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -112.56 146.0 34.1 Favored Pre-proline 0 C--N 1.321 -0.651 0 O-C-N 123.968 0.793 . . . . 0.0 109.936 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.55 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 20.5 Cg_exo . . . . . 0 N--CA 1.461 -0.438 0 C-N-CA 122.361 2.041 . . . . 0.0 110.248 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 p . . . . . 0 C--O 1.233 0.217 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.4 mt -79.52 127.54 32.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.502 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.17 -161.07 0.28 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.253 0.549 . . . . 0.0 111.844 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.68 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 4.5 pt-20 -73.15 132.65 43.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.511 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.39 40.99 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.26 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -107.17 132.85 52.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.74 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.01 132.24 50.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.959 0.409 . . . . 0.0 110.794 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.361 -179.883 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.6 m -66.18 137.8 57.25 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.7 m -62.92 156.86 23.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.464 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -97.26 150.18 36.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 C-N-CA 119.893 -0.723 . . . . 0.0 110.454 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.464 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 98.1 Cg_endo -93.92 35.26 7.87 Favored 'Cis proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.137 -1.61 . . . . 0.0 113.707 1.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.68 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 16.2 m-85 -68.47 154.93 40.9 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.856 0.36 . . . . 0.0 110.314 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -134.41 136.19 43.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.809 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -74.18 120.3 19.57 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -87.51 127.85 35.24 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.403 ' C ' ' H ' ' A' ' 27' ' ' PHE . 1.7 m -129.86 75.91 1.69 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.938 0.774 . . . . 0.0 109.145 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.7 pt -71.46 43.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.403 ' H ' ' C ' ' A' ' 25' ' ' CYS . 4.8 m-85 60.42 16.53 6.41 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.36 0.664 . . . . 0.0 112.081 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.399 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.748 ' CG ' ' HA ' ' A' ' 30' ' ' PRO . 6.7 t80 -80.44 151.77 72.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.748 ' HA ' ' CG ' ' A' ' 29' ' ' TYR . 10.8 Cg_endo -90.79 138.06 10.72 Favored 'Cis proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.599 -1.0 . . . . 0.0 114.192 1.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.424 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 67.9 m -79.25 139.29 37.93 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 177.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -145.01 140.03 27.88 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.213 -0.995 . . . . 0.0 113.099 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.3 129.18 39.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -117.23 151.03 47.31 Favored Pre-proline 0 C--N 1.323 -0.587 0 O-C-N 124.263 0.977 . . . . 0.0 109.662 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.624 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 16.5 Cg_exo . . . . . 0 C--N 1.345 0.348 0 C-N-CA 122.604 2.202 . . . . 0.0 110.907 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.1 p . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 9' ' ' CYS . 61.8 mt -79.7 133.64 36.37 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.83 -164.59 0.61 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.393 0.616 . . . . 0.0 112.004 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.626 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 56.4 tt0 -70.65 132.68 45.79 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.176 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.47 49.17 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.168 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.42 129.94 52.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.756 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.79 126.99 26.4 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.241 0.543 . . . . 0.0 111.821 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.63 ' HA ' HD13 ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.319 179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.6 m -67.55 139.92 56.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.327 0.108 . . . . 0.0 110.964 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.2 m -65.16 138.99 58.62 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.43 149.41 72.01 Favored Pre-proline 0 C--N 1.31 -1.137 0 C-N-CA 120.286 -0.566 . . . . 0.0 110.454 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -96.44 37.74 6.04 Favored 'Cis proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.041 -1.65 . . . . 0.0 113.81 1.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.588 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 6.6 m-85 -74.55 146.53 42.55 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.108 0.48 . . . . 0.0 110.244 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.99 139.3 51.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.43 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 52.8 t -73.23 128.66 36.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.549 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.3 p -112.47 128.02 56.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.107 0.48 . . . . 0.0 111.481 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 86.6 m -111.87 67.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.458 HD11 HH22 ' A' ' 34' ' ' ARG . 18.0 pt -69.87 48.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.39 21.95 11.53 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.422 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.5 m-85 -132.91 133.26 43.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.1 t80 -91.92 130.32 38.9 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.008 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 37.7 Cg_endo -94.79 178.67 9.64 Favored 'Cis proline' 0 N--CA 1.448 -1.15 0 C-N-CA 123.927 -1.281 . . . . 0.0 112.566 -0.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 37.5 m -79.21 156.41 28.18 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.29 135.52 30.68 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.972 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -68.1 132.29 46.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.705 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.458 HH22 HD11 ' A' ' 26' ' ' ILE . 22.6 mmt85 -122.7 155.77 62.62 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.293 0.996 . . . . 0.0 108.997 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.626 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 18.9 Cg_endo . . . . . 0 N--CA 1.463 -0.308 0 C-N-CA 122.357 2.038 . . . . 0.0 110.388 178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.7 p . . . . . 0 N--CA 1.446 -0.661 0 CA-C-O 120.955 0.407 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.679 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -91.39 122.73 34.26 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.335 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.58 -160.25 0.25 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.278 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.67 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 3.9 pm0 -65.97 125.82 26.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.935 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.54 37.78 12.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -99.85 136.07 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.416 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.8 p30 -65.2 136.59 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.351 0.596 . . . . 0.0 110.89 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.668 ' HA ' HD13 ' A' ' 3' ' ' LEU . 7.2 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.847 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 14.8 m . . . . . 0 N--CA 1.455 -0.219 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.514 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 36.6 m -59.83 139.01 57.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.564 0.221 . . . . 0.0 111.104 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.438 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 58.3 m -65.68 148.62 51.45 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.2 OUTLIER -79.72 139.52 54.43 Favored Pre-proline 0 C--N 1.311 -1.079 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.179 179.835 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 62.9 Cg_endo -106.74 46.56 1.9 Allowed 'Cis proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.167 -1.18 . . . . 0.0 113.579 1.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.67 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 3.4 m-85 -72.19 -165.0 0.16 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.196 -0.315 . . . . 0.0 110.884 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.3 tp -167.55 134.95 2.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.666 0.27 . . . . 0.0 110.889 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 35.6 t -72.96 128.64 36.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.696 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.2 p -111.19 127.78 55.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.066 0.46 . . . . 0.0 110.71 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.02 65.32 0.63 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.541 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 20.2 pt -70.29 47.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.189 -178.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 61.33 25.35 15.33 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.231 0.612 . . . . 0.0 112.649 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 16.3 m-85 -132.08 132.55 43.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 0.0 110.202 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 34.3 t80 -92.59 125.93 53.97 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.367 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.457 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.4 Cg_endo -93.41 179.6 10.3 Favored 'Cis proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.945 -1.273 . . . . 0.0 112.133 -0.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.4 m -78.17 163.5 25.77 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 p -144.6 136.55 25.97 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.393 -0.523 . . . . 0.0 112.234 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.6 m -70.65 131.36 43.8 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.167 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -119.61 153.06 54.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.526 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 27.1 Cg_exo . . . . . 0 N--CA 1.461 -0.42 0 C-N-CA 122.251 1.968 . . . . 0.0 110.181 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.4 p . . . . . 0 N--CA 1.445 -0.693 0 CA-C-O 121.048 0.452 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -83.6 129.08 34.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.855 -178.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.519 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.83 -162.74 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.532 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.84 129.36 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.206 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.01 40.21 9.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.682 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.27 135.35 45.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.261 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 140.41 57.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.285 0.564 . . . . 0.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.276 -179.38 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.2 m . . . . . 0 N--CA 1.452 -0.368 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 18.4 m -64.01 138.3 58.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.827 -0.169 . . . . 0.0 111.174 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.0 m -62.51 146.05 52.67 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -82.39 147.18 55.84 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.172 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -98.0 36.79 6.66 Favored 'Cis proline' 0 N--CA 1.45 -1.087 0 C-N-CA 122.997 -1.668 . . . . 0.0 113.686 1.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.532 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 15.0 m-85 -77.8 147.28 35.33 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.032 0.444 . . . . 0.0 110.596 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -126.49 142.36 51.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.623 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.1 t -72.39 126.2 29.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.321 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -104.25 130.17 52.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.051 0.453 . . . . 0.0 110.958 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.5 m -114.51 65.79 0.67 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.39 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.737 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.49 43.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 62.81 22.29 13.31 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 123.103 0.561 . . . . 0.0 112.319 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -125.69 133.38 52.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.43 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 39.3 t80 -92.04 126.99 51.25 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.277 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.43 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.5 Cg_endo -95.36 179.89 8.28 Favored 'Cis proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.961 -1.266 . . . . 0.0 112.257 -0.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 63.4 m -78.13 159.48 28.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -146.87 135.54 22.09 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.543 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.623 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.9 m -67.84 130.02 41.71 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.777 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -126.68 154.11 75.64 Favored Pre-proline 0 C--N 1.323 -0.579 0 O-C-N 124.456 1.098 . . . . 0.0 108.919 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.514 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 46.7 Cg_exo . . . . . 0 N--CA 1.465 -0.171 0 C-N-CA 122.648 2.232 . . . . 0.0 111.576 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.524 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.0 p . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.968 0.413 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 8' ' ' ASP . 77.6 mt -102.11 127.32 49.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.484 -178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.25 -161.1 0.29 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.314 0.578 . . . . 0.0 112.456 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.575 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 10.3 pm0 -66.31 129.53 40.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.98 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.05 41.26 14.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.074 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -104.64 132.36 50.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.621 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.446 ' O ' HD13 ' A' ' 3' ' ' LEU . 7.7 t70 -57.87 134.81 56.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.593 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.512 -0.486 0 CA-C-O 121.966 0.889 . . . . 0.0 112.206 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.7 m . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.4 m -64.52 140.62 58.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.529 0.204 . . . . 0.0 111.194 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.4 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 36.8 m -63.01 143.56 57.66 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -80.45 147.81 64.78 Favored Pre-proline 0 C--N 1.308 -1.229 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.803 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -97.55 34.53 8.66 Favored 'Cis proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.893 -1.711 . . . . 0.0 114.017 1.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.62 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 22.0 m-85 -76.13 161.59 28.71 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -141.8 140.46 33.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.2 t -67.59 132.5 47.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.857 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.3 p -119.5 128.66 54.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.298 0.57 . . . . 0.0 111.654 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 88.4 m -115.87 64.9 0.7 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.1 pt -69.81 48.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.39 20.74 9.05 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.032 0.533 . . . . 0.0 112.23 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.441 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -134.68 136.06 42.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.061 0.458 . . . . 0.0 110.019 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.55 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 43.4 t80 -90.79 134.42 30.54 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.488 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.55 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 60.9 Cg_endo -97.39 172.5 11.22 Favored 'Cis proline' 0 N--CA 1.453 -0.863 0 C-N-CA 124.236 -1.152 . . . . 0.0 113.106 0.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.5 m -79.08 146.21 33.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.3 137.36 21.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.109 -0.636 . . . . 0.0 112.272 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.3 m -66.5 129.94 41.53 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.516 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 21.5 mmt85 -119.7 160.68 41.34 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.62 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.8 Cg_endo . . . . . 0 C--N 1.345 0.347 0 C-N-CA 122.452 2.101 . . . . 0.0 111.569 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.578 HD13 ' SG ' ' A' ' 33' ' ' CYS . 79.8 mt -79.24 134.62 36.65 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.904 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.39 -166.48 0.86 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.212 0.529 . . . . 0.0 112.403 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.735 ' HB2' ' HG3' ' A' ' 35' ' ' PRO . 1.8 pm0 -73.09 129.64 38.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.13 37.08 14.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.608 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.94 140.14 36.63 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.632 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.418 ' O ' HD12 ' A' ' 3' ' ' LEU . 2.5 p30 -62.9 148.73 46.45 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.138 0.494 . . . . 0.0 111.023 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.277 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 9.1 m -73.89 140.51 45.73 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.1 m -61.71 143.11 56.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.76 142.02 65.06 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.773 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -101.46 41.34 3.62 Favored 'Cis proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.088 -1.213 . . . . 0.0 113.935 1.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.649 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 5.9 m-85 -78.25 147.65 34.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -127.17 136.94 52.78 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.7 t -67.52 124.85 24.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.993 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.5 p -110.18 126.81 54.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.101 0.477 . . . . 0.0 111.146 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 98.1 m -114.31 65.62 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.429 ' O ' HG12 ' A' ' 26' ' ' ILE . 16.3 tt -72.67 47.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.047 0.927 . . . . 0.0 112.358 -178.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 59.93 23.13 12.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.993 -1.003 . . . . 0.0 112.481 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -126.61 133.91 50.92 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.421 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 38.4 t80 -92.08 126.98 51.22 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.336 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.421 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 90.4 Cg_endo -95.49 -178.93 7.41 Favored 'Cis proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.363 -0.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.7 m -78.55 164.07 25.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.59 130.46 13.31 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.26 -0.576 . . . . 0.0 112.397 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.1 m -69.28 121.91 17.82 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.439 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 21.6 mmt180 -103.55 147.77 34.72 Favored Pre-proline 0 C--N 1.321 -0.656 0 O-C-N 123.926 0.766 . . . . 0.0 110.216 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.735 ' HG3' ' HB2' ' A' ' 5' ' ' GLU . 10.6 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 122.53 2.153 . . . . 0.0 110.929 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.792 0.329 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -79.87 133.24 36.23 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.229 -179.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.21 -163.55 0.51 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.074 0.464 . . . . 0.0 112.212 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.583 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -72.64 131.53 42.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.327 0.584 . . . . 0.0 111.201 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.92 38.44 11.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.448 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.82 135.33 42.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.973 -179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.401 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 16.5 t70 -59.71 141.07 55.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.41 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 121.951 0.882 . . . . 0.0 111.977 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.448 -0.571 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.4 m -72.67 139.45 47.29 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.406 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 73.3 m -61.8 144.25 55.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.726 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.05 142.46 64.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.768 -178.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -101.87 35.94 6.37 Favored 'Cis proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.298 -1.542 . . . . 0.0 113.677 0.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.594 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 10.0 m-85 -71.36 153.49 42.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.4 tp -133.03 138.91 46.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.603 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.6 t -68.5 122.48 18.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.646 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.5 p -101.99 126.07 48.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.116 0.484 . . . . 0.0 111.457 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 68.7 m -117.38 66.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.1 pt -70.37 46.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.74 21.37 10.15 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.012 0.525 . . . . 0.0 112.148 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.458 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 28.9 m-85 -136.27 138.21 41.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.073 0.463 . . . . 0.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.562 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 40.4 t80 -90.77 135.43 28.98 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.539 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.562 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.0 Cg_endo -97.97 170.53 11.22 Favored 'Cis proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.129 -1.196 . . . . 0.0 113.138 0.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.6 m -79.32 151.93 30.77 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.4 p -149.58 134.31 17.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.532 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.6 m -66.21 127.06 30.69 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.528 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 27.0 mmt180 -118.26 160.95 37.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 124.0 0.813 . . . . 0.0 109.25 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.594 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.7 Cg_endo . . . . . 0 C--N 1.345 0.357 0 C-N-CA 122.616 2.211 . . . . 0.0 111.676 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.616 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 91.4 mt -79.89 128.31 33.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.069 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.5 -162.3 0.4 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.201 0.524 . . . . 0.0 111.796 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.775 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -64.57 128.1 34.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.953 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HB2' ' NH1' ' A' ' 34' ' ' ARG . . . 63.27 47.63 3.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.628 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.616 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -115.87 126.22 53.67 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.118 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.507 ' O ' HD11 ' A' ' 3' ' ' LEU . 1.9 m-20 -54.32 128.26 30.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 112.068 -178.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.054 179.764 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.449 -0.49 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.56 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.5 m -71.59 142.57 50.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.571 0.224 . . . . 0.0 110.78 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 94.0 m -68.22 143.84 55.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.676 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.83 144.23 59.59 Favored Pre-proline 0 C--N 1.312 -1.039 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -103.18 38.94 4.34 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.785 -1.339 . . . . 0.0 113.688 1.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.775 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.9 m-85 -69.47 160.51 31.28 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.9 tp -125.04 134.79 52.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.872 0.368 . . . . 0.0 111.337 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.56 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 52.7 t -74.88 116.69 15.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.0 p -96.9 126.42 42.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.079 0.466 . . . . 0.0 111.457 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 83.3 m -117.63 66.59 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.118 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.453 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.1 tp -73.66 53.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 122.408 1.099 . . . . 0.0 112.408 -178.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.57 23.11 7.3 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.884 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.59 134.18 48.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.897 0.379 . . . . 0.0 110.153 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.468 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 42.5 t80 -92.26 128.55 44.56 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.936 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.468 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 72.6 Cg_endo -94.77 -179.29 8.18 Favored 'Cis proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.84 -1.317 . . . . 0.0 112.304 -0.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.1 m -79.25 171.82 14.66 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -153.42 129.96 10.69 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.261 -0.575 . . . . 0.0 111.855 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.31 127.5 33.17 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.414 ' NH1' ' HB2' ' A' ' 6' ' ' ALA . 27.9 mmt180 -120.0 147.2 43.91 Favored Pre-proline 0 C--N 1.319 -0.738 0 O-C-N 123.764 0.665 . . . . 0.0 109.302 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.553 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 34.6 Cg_exo . . . . . 0 N--CA 1.461 -0.386 0 C-N-CA 122.303 2.002 . . . . 0.0 110.695 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 120.868 0.366 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.637 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 82.6 mt -82.83 131.42 35.2 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.448 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.23 -161.97 0.36 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.498 ' OE2' ' HD3' ' A' ' 35' ' ' PRO . 16.7 tp10 -68.2 134.77 50.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.273 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.42 49.16 13.41 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.308 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -117.59 124.08 47.77 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.134 -0.626 . . . . 0.0 112.069 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.431 ' O ' HD13 ' A' ' 3' ' ' LEU . 75.6 m-20 -54.59 126.17 22.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.246 0.545 . . . . 0.0 111.183 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.136 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 22.1 m -65.1 136.43 56.72 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.434 0.159 . . . . 0.0 111.309 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.9 m -61.4 141.67 57.48 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.59 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 25.9 mmmt -79.8 151.28 73.62 Favored Pre-proline 0 C--N 1.308 -1.204 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.248 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.59 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 88.6 Cg_endo -94.38 30.21 14.27 Favored 'Cis proline' 0 N--CA 1.452 -0.969 0 C-N-CA 122.808 -1.747 . . . . 0.0 114.022 1.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 27.8 m-85 -71.12 163.69 27.11 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.698 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 tp -139.85 142.3 36.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 43.8 t -69.61 129.09 38.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.727 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.6 p -114.51 127.93 56.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.145 0.497 . . . . 0.0 111.365 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 96.7 m -113.76 66.24 0.66 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.35 -0.841 . . . . 0.0 108.777 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.421 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.0 pt -69.84 47.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.04 22.79 11.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.514 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.421 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.1 m-85 -133.55 135.64 44.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.911 0.386 . . . . 0.0 109.98 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.484 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 36.0 t80 -91.53 130.22 40.08 Favored Pre-proline 0 C--N 1.315 -0.908 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.914 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.484 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 57.6 Cg_endo -96.92 178.05 8.25 Favored 'Cis proline' 0 N--CA 1.451 -1.008 0 C-N-CA 124.202 -1.166 . . . . 0.0 112.734 -0.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.5 m -79.48 151.51 30.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.413 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -144.3 138.4 27.88 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.734 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.3 m -67.58 133.66 49.82 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.595 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.0 mmt85 -130.72 169.07 14.55 Favored Pre-proline 0 C--O 1.236 0.387 0 O-C-N 125.193 1.558 . . . . 0.0 107.776 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.595 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 29.6 Cg_endo . . . . . 0 C--N 1.349 0.6 0 C-N-CA 121.931 1.754 . . . . 0.0 111.85 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.648 0.261 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 89.2 mt -79.99 136.82 36.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.648 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.03 -163.22 0.46 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.329 0.585 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.595 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 36.1 tt0 -74.74 133.26 42.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.533 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.95 43.54 9.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.14 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.564 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.88 137.64 45.53 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.381 -178.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.52 ' O ' HD11 ' A' ' 3' ' ' LEU . 10.0 t70 -59.73 135.31 57.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.192 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 CA-C-O 121.766 0.793 . . . . 0.0 112.485 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.219 -0.545 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 20.9 m -69.5 138.03 53.03 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.918 -0.128 . . . . 0.0 111.029 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.0 m -62.96 142.88 58.18 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -80.38 149.04 68.1 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.447 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -96.36 37.64 6.1 Favored 'Cis proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.061 -1.641 . . . . 0.0 113.646 1.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.583 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 7.0 m-85 -77.13 148.91 35.75 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.169 0.509 . . . . 0.0 110.928 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 tp -126.76 140.73 52.16 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.292 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.9 t -69.65 121.92 18.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.867 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -96.76 122.64 39.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.3 m -121.22 59.22 0.95 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.593 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.1 pt -71.27 46.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 59.44 20.63 9.0 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.004 0.522 . . . . 0.0 111.996 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.17 136.01 50.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.063 0.459 . . . . 0.0 109.937 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.532 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 46.0 t80 -91.08 132.81 33.24 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.529 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.532 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 90.5 Cg_endo -99.05 172.05 9.24 Favored 'Cis proline' 0 N--CA 1.453 -0.859 0 C-N-CA 124.372 -1.095 . . . . 0.0 113.128 -0.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.4 m -79.25 149.08 31.97 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -150.92 134.52 16.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.769 -0.772 . . . . 0.0 112.622 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -64.58 127.95 33.71 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.489 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.0 mmt180 -120.01 159.47 46.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.432 1.082 . . . . 0.0 109.418 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.595 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 23.0 Cg_endo . . . . . 0 N--CA 1.461 -0.401 0 C-N-CA 122.376 2.051 . . . . 0.0 111.187 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.572 HD11 ' HA ' ' A' ' 9' ' ' CYS . 78.5 mt -80.64 126.14 30.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.16 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.18 -164.99 0.69 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.038 0.446 . . . . 0.0 111.86 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.571 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.7 pm0 -68.42 129.85 41.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.303 0.573 . . . . 0.0 111.235 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.9 40.37 5.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.91 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.49 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -110.05 124.46 51.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.596 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -62.29 130.03 43.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.431 0.634 . . . . 0.0 111.543 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.572 ' HA ' HD11 ' A' ' 3' ' ' LEU . 2.8 m . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.79 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.6 m -65.63 139.54 58.43 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 121.33 -0.148 . . . . 0.0 110.77 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.451 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 57.6 m -65.38 146.65 54.63 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -79.55 140.43 55.61 Favored Pre-proline 0 C--N 1.31 -1.12 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -102.2 42.48 3.12 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.413 -1.078 . . . . 0.0 113.543 0.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.731 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -79.69 143.65 34.41 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.8 tp -120.66 139.36 53.13 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.921 0.391 . . . . 0.0 112.019 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.5 t -71.57 124.54 24.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.768 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -103.34 129.0 50.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.013 0.435 . . . . 0.0 111.294 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.4 m -115.88 65.91 0.7 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.256 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.802 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.76 43.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.574 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 61.91 21.75 12.52 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 122.978 0.511 . . . . 0.0 112.067 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -127.45 136.05 51.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.432 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 41.9 t80 -91.42 128.24 47.65 Favored Pre-proline 0 C--N 1.316 -0.853 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.087 179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.0 Cg_endo -97.71 178.26 7.54 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 124.134 -1.194 . . . . 0.0 112.708 -0.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 69.7 m -79.46 149.24 31.62 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -139.95 138.17 35.34 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.398 -0.521 . . . . 0.0 112.143 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.7 m -69.49 130.8 43.48 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -117.71 153.49 50.7 Favored Pre-proline 0 C--N 1.321 -0.667 0 O-C-N 123.799 0.687 . . . . 0.0 109.257 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.731 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.2 Cg_endo . . . . . 0 N--CA 1.459 -0.542 0 C-N-CA 122.335 2.023 . . . . 0.0 111.566 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 23.9 p . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.593 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 75.0 mt -80.68 126.31 31.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.699 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.34 -159.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.136 0.493 . . . . 0.0 112.104 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.646 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.8 128.12 34.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.269 0.557 . . . . 0.0 111.241 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.25 39.1 7.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.484 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.593 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -100.34 132.39 45.74 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.485 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 49.5 t0 -61.87 132.96 54.76 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.521 0.513 . . . . 0.0 110.671 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.505 ' HA ' HD13 ' A' ' 3' ' ' LEU . 4.0 m . . . . . 0 C--N 1.324 -0.519 0 CA-C-O 121.169 0.509 . . . . 0.0 110.861 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 m . . . . . 0 N--CA 1.449 -0.476 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 35.1 m -64.69 140.79 58.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.408 0.147 . . . . 0.0 111.121 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -65.83 145.74 55.59 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.79 140.23 58.54 Favored Pre-proline 0 C--N 1.309 -1.153 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.956 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -102.29 38.13 5.01 Favored 'Cis proline' 0 N--CA 1.455 -0.773 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.403 0.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.646 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.2 m-85 -70.73 145.69 50.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 110.097 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 tp -123.82 139.68 53.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.036 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 40.2 t -70.47 125.62 27.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.069 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.5 p -100.15 128.64 46.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.021 0.438 . . . . 0.0 111.286 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 45.8 m -120.09 69.0 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.79 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 15.6 pt -70.57 46.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.73 21.23 10.0 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.147 0.579 . . . . 0.0 112.132 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 64.9 m-85 -144.41 140.3 28.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.221 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.694 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 30.0 t80 -90.45 142.62 28.34 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.694 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.4 Cg_endo -94.59 157.97 16.51 Favored 'Cis proline' 0 N--CA 1.455 -0.74 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.626 0.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.9 m -78.73 139.62 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.26 140.08 37.57 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.72 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.7 m -65.23 131.24 45.99 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.697 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.7 mmt85 -124.82 152.11 69.23 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.0 0.813 . . . . 0.0 109.435 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.447 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 45.9 Cg_exo . . . . . 0 C--N 1.344 0.311 0 C-N-CA 122.789 2.326 . . . . 0.0 112.114 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.464 HD11 ' O ' ' A' ' 8' ' ' ASP . 90.8 mt -79.41 136.62 37.01 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.437 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.53 -169.06 1.55 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -71.56 134.17 46.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.26 40.77 24.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.481 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.71 145.73 30.71 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.986 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.464 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.2 p30 -65.15 151.69 45.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.99 0.424 . . . . 0.0 110.594 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.448 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 7.6 p . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.783 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.593 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 29.9 m -74.74 142.43 44.36 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -63.0 145.93 54.32 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.493 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -77.82 141.78 64.44 Favored Pre-proline 0 C--N 1.312 -1.038 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.599 -178.867 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -102.68 39.02 4.46 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.17 -1.179 . . . . 0.0 113.941 1.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.78 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 55.3 m-85 -77.13 146.06 37.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 0.0 110.744 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -119.71 137.43 53.93 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.495 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.593 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 53.5 t -71.83 115.33 10.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.701 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.5 p -95.99 127.13 41.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.058 0.456 . . . . 0.0 110.964 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 95.4 m -116.52 69.92 0.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.443 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.4 pt -69.07 48.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 61.39 22.45 12.84 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.443 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 63.0 m-85 -140.48 131.37 26.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.008 0.433 . . . . 0.0 110.235 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.557 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 5.9 t80 -92.09 136.54 25.83 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.822 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.557 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 96.3 Cg_endo -88.19 170.39 35.06 Favored 'Cis proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.667 -1.389 . . . . 0.0 112.625 -0.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.2 m -78.91 178.5 7.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.6 p -156.27 128.38 7.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.299 -0.56 . . . . 0.0 112.282 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.5 m -69.4 124.42 23.83 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.474 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 31.9 mmt180 -118.58 158.8 46.23 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.027 0.829 . . . . 0.0 109.714 -179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.78 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 19.4 Cg_endo . . . . . 0 C--N 1.344 0.293 0 C-N-CA 122.523 2.149 . . . . 0.0 112.138 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 16' ' ' SER . 22.3 p . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 120.915 0.388 . . . . 0.0 109.997 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.468 HD12 ' O ' ' A' ' 8' ' ' ASP . 89.6 mt -82.5 132.05 35.21 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.2 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.69 -165.74 0.77 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 0.0 111.633 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.506 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 5.8 pt-20 -76.31 138.52 40.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.297 0.57 . . . . 0.0 111.14 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 63.31 39.48 9.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.964 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.82 138.74 45.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.011 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.468 ' O ' HD12 ' A' ' 3' ' ' LEU . 25.9 t70 -57.34 141.49 46.83 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.39 0.431 . . . . 0.0 110.488 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HB3' HD13 ' A' ' 3' ' ' LEU . 17.0 p . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.55 0.69 . . . . 0.0 111.94 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 2.3 m . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.2 m -76.29 144.68 40.12 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.353 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -63.93 148.72 48.85 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -79.12 141.82 58.68 Favored Pre-proline 0 C--N 1.31 -1.118 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -101.57 35.53 6.74 Favored 'Cis proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.995 -1.252 . . . . 0.0 113.599 0.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.867 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 25.6 m-85 -74.12 155.27 38.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -134.15 138.69 45.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.866 0.365 . . . . 0.0 111.689 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 49.9 t -68.85 120.81 15.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.576 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.3 p -102.05 124.72 48.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.279 0.561 . . . . 0.0 111.682 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 61.6 m -119.54 56.54 0.93 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.601 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.2 pt -71.49 46.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 61.28 19.02 9.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.944 0.498 . . . . 0.0 112.08 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -120.9 131.92 54.66 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 50.0 t80 -91.63 129.03 44.09 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.127 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 91.6 Cg_endo -97.28 178.71 7.63 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.16 -1.183 . . . . 0.0 112.453 -0.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 75.4 m -78.86 151.06 32.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -149.77 134.75 17.91 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.979 -0.689 . . . . 0.0 112.247 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.2 m -67.66 130.59 43.5 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -122.3 151.42 59.11 Favored Pre-proline 0 C--N 1.32 -0.684 0 O-C-N 124.175 0.922 . . . . 0.0 110.076 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.867 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 38.4 Cg_exo . . . . . 0 N--CA 1.462 -0.364 0 C-N-CA 122.393 2.062 . . . . 0.0 110.48 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.8 p . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.475 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 80.2 mt -79.61 135.45 36.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.983 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.45 -166.82 0.92 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.174 0.511 . . . . 0.0 112.363 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.412 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 1.7 pm0 -73.78 132.36 42.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.058 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.73 38.37 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.544 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.85 141.46 36.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.454 ' O ' HD11 ' A' ' 3' ' ' LEU . 2.3 p30 -64.93 148.85 50.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.111 0.481 . . . . 0.0 110.894 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.475 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.324 -0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 111.099 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.448 -0.528 0 CA-C-O 120.696 0.284 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 13.2 m -75.24 142.91 43.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.1 m -63.23 143.62 57.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -78.14 144.45 67.22 Favored Pre-proline 0 C--N 1.313 -1.018 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.139 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -101.19 40.09 4.31 Favored 'Cis proline' 0 N--CA 1.451 -0.989 0 C-N-CA 123.473 -1.47 . . . . 0.0 113.706 1.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.67 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 7.8 m-85 -77.48 145.03 37.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.894 0.378 . . . . 0.0 110.435 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.7 tp -120.23 137.54 54.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -71.27 120.77 17.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.883 179.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.4 p -103.88 129.04 51.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.05 0.452 . . . . 0.0 111.037 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.6 m -114.84 66.98 0.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.6 pt -70.28 47.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.91 22.06 12.24 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -129.71 133.26 46.95 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.481 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.2 t80 -92.38 128.6 44.11 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.171 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.481 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 91.4 Cg_endo -93.32 -177.89 8.18 Favored 'Cis proline' 0 N--CA 1.451 -1.016 0 C-N-CA 123.713 -1.369 . . . . 0.0 112.197 -0.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -78.55 171.56 14.94 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.7 p -152.95 128.93 10.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.6 m -69.3 127.13 31.95 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -117.63 149.65 45.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 124.038 0.836 . . . . 0.0 110.119 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.67 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.9 Cg_exo . . . . . 0 C--N 1.344 0.335 0 C-N-CA 122.898 2.399 . . . . 0.0 111.814 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.1 p . . . . . 0 N--CA 1.447 -0.603 0 CA-C-O 122.038 0.923 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.505 HD11 ' SG ' ' A' ' 33' ' ' CYS . 91.6 mt -79.61 130.1 35.07 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.62 -1.627 . . . . 0.0 111.065 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.36 -164.05 0.58 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.224 0.535 . . . . 0.0 112.203 -179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -66.62 128.31 35.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.972 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.74 37.33 7.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.333 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -98.86 128.32 45.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.923 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -67.88 153.81 42.93 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.29 0.567 . . . . 0.0 111.902 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 4.0 p . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.634 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.63 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.8 m . . . . . 0 N--CA 1.452 -0.369 0 CA-C-O 120.733 0.302 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.4 m -73.37 146.83 44.88 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.19 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.413 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 63.3 m -63.02 140.59 58.89 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -77.99 141.78 63.67 Favored Pre-proline 0 C--N 1.312 -1.036 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.807 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -101.28 45.55 2.58 Favored 'Cis proline' 0 CA--C 1.538 0.712 0 C-N-CA 124.171 -1.179 . . . . 0.0 114.052 1.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.578 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 4.7 m-30 -79.47 148.46 31.88 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -128.29 134.79 49.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.131 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 2.5 t -75.19 116.56 16.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.462 0.648 . . . . 0.0 109.95 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.4 p -84.86 123.25 30.25 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.472 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.3 m -112.69 64.82 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.055 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.452 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.2 pt -70.93 47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 61.67 21.11 11.9 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.103 0.561 . . . . 0.0 112.417 178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.452 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -133.46 132.69 41.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.042 0.448 . . . . 0.0 109.892 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 12.6 t80 -91.83 133.62 30.4 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.895 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.582 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.91 174.14 15.44 Favored 'Cis proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.936 -1.277 . . . . 0.0 112.677 -0.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.465 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 57.3 m -79.1 164.24 24.45 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -147.46 124.61 11.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.96 -0.696 . . . . 0.0 112.678 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.3 m -65.48 124.59 22.7 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.832 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -111.01 149.31 40.26 Favored Pre-proline 0 C--N 1.318 -0.782 0 O-C-N 124.135 0.897 . . . . 0.0 108.849 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.578 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 27.5 Cg_endo . . . . . 0 N--CA 1.459 -0.558 0 C-N-CA 122.553 2.168 . . . . 0.0 110.408 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.591 HD11 ' O ' ' A' ' 8' ' ' ASP . 81.2 mt -86.07 133.53 33.89 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.677 -178.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.483 ' HB2' ' OE2' ' A' ' 5' ' ' GLU . . . -79.53 -161.32 0.32 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.806 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -73.87 130.08 39.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.247 0.546 . . . . 0.0 111.395 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.26 38.9 7.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.736 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -101.17 137.32 39.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.959 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.591 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.7 p30 -61.32 142.95 56.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 110.946 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p . . . . . 0 C--N 1.326 -0.416 0 CA-C-O 121.46 0.648 . . . . 0.0 111.503 -178.971 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 33.4 m -72.52 139.97 47.9 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.8 m -63.2 146.0 54.3 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.58 139.74 59.11 Favored Pre-proline 0 C--N 1.311 -1.07 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.636 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -103.95 37.2 4.87 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.844 -1.315 . . . . 0.0 113.686 1.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.663 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 4.9 m-85 -66.73 156.56 35.04 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.397 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.4 tp -130.79 134.96 47.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.785 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.6 t -70.06 120.57 15.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.767 -0.652 . . . . 0.0 109.674 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.3 p -101.4 121.08 41.27 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.099 0.476 . . . . 0.0 111.666 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.3 m -112.12 62.57 0.62 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.457 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.0 tp -74.25 54.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 122.285 1.04 . . . . 0.0 112.445 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 55.95 23.46 6.67 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.373 -1.285 . . . . 0.0 112.897 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -128.77 133.62 48.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.019 0.438 . . . . 0.0 110.172 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 41.6 t80 -92.03 128.27 46.21 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.444 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.3 Cg_endo -95.69 179.61 8.22 Favored 'Cis proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.981 -1.258 . . . . 0.0 112.212 -0.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.82 162.04 26.37 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -147.67 129.87 15.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.431 -0.508 . . . . 0.0 112.263 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.5 m -69.0 127.53 33.47 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 36.4 mtt180 -116.85 160.19 37.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 123.768 0.667 . . . . 0.0 110.013 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.543 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 19.6 Cg_endo . . . . . 0 N--CA 1.462 -0.325 0 C-N-CA 122.284 1.99 . . . . 0.0 111.352 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.2 p . . . . . 0 N--CA 1.448 -0.542 0 CA-C-O 121.271 0.558 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 90.5 mt -88.57 140.27 29.63 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.621 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.24 -177.07 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.052 0.453 . . . . 0.0 111.752 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.515 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.4 pt-20 -71.8 140.01 49.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.031 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 42.43 17.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.661 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.34 145.26 46.32 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.712 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -61.67 149.95 38.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.919 0.39 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 C--N 1.327 -0.411 0 CA-C-O 121.787 0.803 . . . . 0.0 111.995 -179.081 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.592 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.6 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 14.6 m -65.13 144.04 57.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.544 0.211 . . . . 0.0 111.121 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.2 m -64.01 141.51 58.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -79.49 149.11 71.33 Favored Pre-proline 0 C--N 1.31 -1.117 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.936 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -96.71 34.4 8.89 Favored 'Cis proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.805 -1.748 . . . . 0.0 113.829 1.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.865 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 34.0 m-85 -77.94 145.17 36.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.872 0.367 . . . . 0.0 110.358 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -121.17 141.45 50.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.713 -178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.8 t -71.36 122.45 20.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.675 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -105.96 127.87 53.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 111.25 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.7 m -114.32 64.76 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 26' ' ' ILE . 9.9 tp -73.28 55.01 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.356 1.074 . . . . 0.0 112.484 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.11 23.67 7.15 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.366 -1.288 . . . . 0.0 112.992 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -127.91 132.95 49.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.991 0.424 . . . . 0.0 110.111 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.439 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 37.8 t80 -92.45 127.25 49.34 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.17 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.439 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.65 -177.7 7.81 Favored 'Cis proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.82 -1.325 . . . . 0.0 112.212 -0.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.15 165.18 24.27 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -149.51 131.97 15.7 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.487 -0.485 . . . . 0.0 112.037 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -70.18 132.37 45.68 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.505 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 30.1 mmt180 -126.74 160.63 57.71 Favored Pre-proline 0 C--N 1.322 -0.623 0 O-C-N 124.171 0.919 . . . . 0.0 109.016 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.865 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 18.8 Cg_endo . . . . . 0 C--N 1.343 0.279 0 C-N-CA 122.341 2.027 . . . . 0.0 111.17 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.429 ' HD2' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' N ' ' HD2' ' A' ' 1' ' ' LYS . 25.3 p -160.96 157.48 26.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.872 0.368 . . . . 0.0 110.5 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.449 ' HG ' ' HB3' ' A' ' 15' ' ' ASP . 86.4 mt -85.74 130.54 34.53 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.107 -179.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 7' ' ' ALA . . . -78.92 -166.4 0.9 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.112 0.482 . . . . 0.0 112.269 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.524 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.3 pm0 -70.98 134.69 47.36 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.468 0.651 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.18 38.8 10.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.623 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' ALA . . . -106.5 135.92 47.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.638 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.432 ' O ' HD11 ' A' ' 3' ' ' LEU . 10.0 t70 -59.5 139.05 57.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.259 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.429 ' HB3' HD12 ' A' ' 3' ' ' LEU . 1.6 p -138.92 148.15 43.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.95 0.881 . . . . 0.0 112.371 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 13' ' ' SER . 57.8 m -148.98 145.53 19.74 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 114.123 -1.399 . . . . 0.0 109.066 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.0 -47.29 24.23 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 123.798 2.999 . . . . 0.0 113.338 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -108.75 -51.48 2.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.6 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.5 m -80.29 58.7 3.16 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.396 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.38 -135.61 1.89 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.235 -0.984 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.449 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 34.4 t0 -168.49 171.96 8.59 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.404 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.1 m -79.91 139.61 37.02 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.526 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 11.7 m -74.67 140.59 44.32 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 121.126 -0.23 . . . . 0.0 110.456 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.3 m -62.28 147.63 47.47 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -85.58 148.6 49.53 Favored Pre-proline 0 C--N 1.308 -1.213 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.22 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 96.2 Cg_endo -95.55 32.76 10.65 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.895 -1.71 . . . . 0.0 113.684 1.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.786 ' HD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -75.32 145.5 41.72 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 tp -128.38 140.51 51.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.798 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.2 t -68.29 122.55 18.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.3 p -101.66 124.34 47.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.153 0.501 . . . . 0.0 111.26 -179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.2 m -119.48 66.25 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.549 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.439 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.3 pt -70.85 45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 59.6 21.34 9.94 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.011 0.524 . . . . 0.0 111.932 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 23.8 m-85 -135.32 139.31 44.22 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.53 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 61.1 t80 -90.67 134.95 29.73 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.392 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.53 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 81.0 Cg_endo -98.92 168.74 10.29 Favored 'Cis proline' 0 N--CA 1.454 -0.851 0 C-N-CA 124.348 -1.105 . . . . 0.0 113.159 0.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.0 m -79.49 151.44 30.79 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.48 134.39 16.79 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.385 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 6.9 m -67.41 130.04 41.82 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -119.91 156.07 54.61 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 123.858 0.724 . . . . 0.0 109.844 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.786 ' HA ' ' HD2' ' A' ' 21' ' ' TYR . 19.8 Cg_endo -61.74 149.91 88.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.458 2.105 . . . . 0.0 110.477 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.507 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 25.0 tptt -78.48 144.89 35.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.397 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.14 -33.22 1.93 Allowed Glycine 0 N--CA 1.443 -0.845 0 N-CA-C 108.021 -2.031 . . . . 0.0 108.021 -177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 . . . . . 0 C--O 1.241 0.616 0 CA-C-N 113.979 -1.111 . . . . 0.0 108.298 177.186 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.0 pttp . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -161.33 159.63 28.67 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 123.428 0.455 . . . . 0.0 109.911 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.657 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 84.9 mt -79.68 126.13 30.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.69 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.55 -159.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.315 0.579 . . . . 0.0 112.503 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.791 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -65.88 127.61 32.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.095 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.53 42.22 11.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.941 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.657 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -107.79 120.7 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.791 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.505 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 58.1 m-20 -58.47 125.88 25.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.02 141.07 28.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.581 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.438 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 6.0 m -79.26 128.38 75.88 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.029 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.447 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 49.9 Cg_endo -68.63 -51.46 0.51 Allowed 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.055 2.503 . . . . 0.0 114.191 -178.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.447 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.2 m-90 -79.64 -51.18 9.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.641 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -159.89 134.07 7.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.489 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -178.42 -146.91 6.72 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.49 158.07 15.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.114 0.483 . . . . 0.0 111.131 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 m -92.42 149.59 21.31 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.589 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.9 m -69.39 142.78 53.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.625 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -66.09 146.23 54.9 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.45 140.43 55.99 Favored Pre-proline 0 C--N 1.31 -1.113 0 C-N-CA 120.689 -0.405 . . . . 0.0 110.361 -179.718 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -102.99 41.66 3.22 Favored 'Cis proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.399 -1.084 . . . . 0.0 113.553 1.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.791 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 1.7 m-85 -71.68 144.0 49.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -117.64 133.73 55.63 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.297 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.5 t -71.06 122.46 20.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.4 p -102.14 126.35 49.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.105 0.478 . . . . 0.0 111.726 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.0 m -114.3 64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.044 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.4 pt -71.21 45.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.67 20.93 10.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.071 0.548 . . . . 0.0 112.243 178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -128.81 135.38 49.06 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 31.6 t80 -91.52 129.98 40.94 Favored Pre-proline 0 C--N 1.316 -0.89 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.944 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.478 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 97.1 Cg_endo -97.18 178.51 7.81 Favored 'Cis proline' 0 N--CA 1.451 -1.013 0 C-N-CA 124.042 -1.232 . . . . 0.0 112.714 -0.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.1 m -79.62 149.89 31.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 1.4 p -138.96 135.63 34.56 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.49 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.0 m -67.0 127.08 31.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.503 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -112.56 146.0 34.1 Favored Pre-proline 0 C--N 1.321 -0.651 0 O-C-N 123.968 0.793 . . . . 0.0 109.936 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.55 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 20.5 Cg_exo -60.41 146.91 95.78 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.361 2.041 . . . . 0.0 110.248 178.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.462 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 31.1 tptt -79.37 140.47 37.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.362 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.23 31.38 0.12 Allowed Glycine 0 C--N 1.314 -0.646 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.836 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.26 1.647 0 CA-C-O 117.086 -1.435 . . . . 0.0 107.245 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.578 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 17.4 tptm . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 p -161.79 160.99 28.96 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 123.271 0.357 . . . . 0.0 110.171 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.4 mt -79.52 127.54 32.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.502 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.17 -161.07 0.28 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.253 0.549 . . . . 0.0 111.844 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.68 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 4.5 pt-20 -73.15 132.65 43.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.511 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.39 40.99 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.26 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -107.17 132.85 52.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.74 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.01 132.24 50.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.959 0.409 . . . . 0.0 110.794 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.7 m -89.94 153.47 20.59 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.361 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.0 m -78.62 129.17 75.0 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.123 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.47 -55.13 2.32 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.409 2.739 . . . . 0.0 113.906 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -91.19 -57.03 2.93 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.344 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.6 m -161.37 145.63 13.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.075 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.06 -144.39 7.79 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.124 -0.56 . . . . 0.0 111.754 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.578 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.5 OUTLIER -68.0 150.35 48.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.376 0.608 . . . . 0.0 111.448 179.555 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.1 m -103.1 146.85 27.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.757 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.6 m -66.18 137.8 57.25 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.7 m -62.92 156.86 23.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.464 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -97.26 150.18 36.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 C-N-CA 119.893 -0.723 . . . . 0.0 110.454 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.464 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 98.1 Cg_endo -93.92 35.26 7.87 Favored 'Cis proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.137 -1.61 . . . . 0.0 113.707 1.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.68 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 16.2 m-85 -68.47 154.93 40.9 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.856 0.36 . . . . 0.0 110.314 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -134.41 136.19 43.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.809 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -74.18 120.3 19.57 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -87.51 127.85 35.24 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.403 ' C ' ' H ' ' A' ' 27' ' ' PHE . 1.7 m -129.86 75.91 1.69 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.938 0.774 . . . . 0.0 109.145 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.7 pt -71.46 43.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.403 ' H ' ' C ' ' A' ' 25' ' ' CYS . 4.8 m-85 60.42 16.53 6.41 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.36 0.664 . . . . 0.0 112.081 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.399 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.748 ' CG ' ' HA ' ' A' ' 30' ' ' PRO . 6.7 t80 -80.44 151.77 72.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.748 ' HA ' ' CG ' ' A' ' 29' ' ' TYR . 10.8 Cg_endo -90.79 138.06 10.72 Favored 'Cis proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.599 -1.0 . . . . 0.0 114.192 1.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.424 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 67.9 m -79.25 139.29 37.93 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 177.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -145.01 140.03 27.88 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.213 -0.995 . . . . 0.0 113.099 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.622 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.3 129.18 39.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -117.23 151.03 47.31 Favored Pre-proline 0 C--N 1.323 -0.587 0 O-C-N 124.263 0.977 . . . . 0.0 109.662 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.624 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 16.5 Cg_exo -60.29 150.96 77.23 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.604 2.202 . . . . 0.0 110.907 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 36' ' ' LYS . 1.5 tppt? -78.54 126.37 30.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.964 0.888 . . . . 0.0 109.58 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.437 ' H ' ' HD3' ' A' ' 36' ' ' LYS . . . 141.78 -24.45 2.45 Favored Glycine 0 N--CA 1.442 -0.915 0 N-CA-C 105.779 -2.928 . . . . 0.0 105.779 -175.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 . . . . . 0 N--CA 1.443 -0.798 0 CA-C-N 112.492 -1.854 . . . . 0.0 107.216 176.911 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.2 tptm . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.1 p -161.59 158.81 26.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.742 0.306 . . . . 0.0 110.337 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 9' ' ' CYS . 61.8 mt -79.7 133.64 36.37 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.83 -164.59 0.61 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.393 0.616 . . . . 0.0 112.004 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.626 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 56.4 tt0 -70.65 132.68 45.79 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.176 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.47 49.17 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.168 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.42 129.94 52.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.756 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.79 126.99 26.4 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.241 0.543 . . . . 0.0 111.821 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.63 ' HA ' HD13 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -102.96 148.37 25.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.319 179.732 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.29 126.29 81.68 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.983 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.38 -57.02 0.24 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.992 2.461 . . . . 0.0 114.015 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.9 m-90 -79.9 -54.14 6.1 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.3 m -159.32 139.54 12.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.583 0.23 . . . . 0.0 110.908 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.44 -152.18 21.01 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -70.43 142.74 51.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.129 0.49 . . . . 0.0 110.422 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 m -94.17 148.48 22.14 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.429 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.6 m -67.55 139.92 56.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.327 0.108 . . . . 0.0 110.964 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.2 m -65.16 138.99 58.62 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.43 149.41 72.01 Favored Pre-proline 0 C--N 1.31 -1.137 0 C-N-CA 120.286 -0.566 . . . . 0.0 110.454 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.422 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -96.44 37.74 6.04 Favored 'Cis proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.041 -1.65 . . . . 0.0 113.81 1.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.588 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 6.6 m-85 -74.55 146.53 42.55 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.108 0.48 . . . . 0.0 110.244 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.99 139.3 51.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.43 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 52.8 t -73.23 128.66 36.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.549 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.3 p -112.47 128.02 56.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.107 0.48 . . . . 0.0 111.481 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 86.6 m -111.87 67.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.458 HD11 HH22 ' A' ' 34' ' ' ARG . 18.0 pt -69.87 48.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.39 21.95 11.53 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.422 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.5 m-85 -132.91 133.26 43.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.1 t80 -91.92 130.32 38.9 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.008 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 37.7 Cg_endo -94.79 178.67 9.64 Favored 'Cis proline' 0 N--CA 1.448 -1.15 0 C-N-CA 123.927 -1.281 . . . . 0.0 112.566 -0.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 37.5 m -79.21 156.41 28.18 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.29 135.52 30.68 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.972 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -68.1 132.29 46.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.705 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.458 HH22 HD11 ' A' ' 26' ' ' ILE . 22.6 mmt85 -122.7 155.77 62.62 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.293 0.996 . . . . 0.0 108.997 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.626 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 18.9 Cg_endo -60.29 150.43 80.2 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.357 2.038 . . . . 0.0 110.388 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 17.6 tptt -78.56 140.51 38.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.397 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.2 -33.19 1.93 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 -177.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 . . . . . 0 C--O 1.242 0.687 0 CA-C-N 113.946 -1.127 . . . . 0.0 108.309 177.049 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.7 p -149.62 157.74 43.53 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.955 0.407 . . . . 0.0 110.287 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.679 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -91.39 122.73 34.26 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.335 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.58 -160.25 0.25 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.278 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.67 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 3.9 pm0 -65.97 125.82 26.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.935 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.54 37.78 12.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -99.85 136.07 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.416 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.8 p30 -65.2 136.59 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.351 0.596 . . . . 0.0 110.89 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.668 ' HA ' HD13 ' A' ' 3' ' ' LEU . 7.2 m -90.74 156.09 18.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.847 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.476 ' OG ' ' HA3' ' A' ' 14' ' ' GLY . 15.4 m -78.74 140.46 58.91 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.957 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.435 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 21.6 Cg_exo -65.09 -59.55 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.925 2.417 . . . . 0.0 113.668 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 17.5 m-90 -113.08 -34.94 5.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.692 -178.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m -155.69 141.08 17.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.61 0.243 . . . . 0.0 111.033 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA3' ' OG ' ' A' ' 10' ' ' SER . . . 167.14 -146.03 10.39 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.72 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -87.49 145.51 26.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.0 110.82 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 14.8 m -93.74 155.64 17.12 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.727 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.514 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 36.6 m -59.83 139.01 57.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.564 0.221 . . . . 0.0 111.104 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.438 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 58.3 m -65.68 148.62 51.45 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.2 OUTLIER -79.72 139.52 54.43 Favored Pre-proline 0 C--N 1.311 -1.079 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.179 179.835 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.431 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 62.9 Cg_endo -106.74 46.56 1.9 Allowed 'Cis proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.167 -1.18 . . . . 0.0 113.579 1.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.67 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 3.4 m-85 -72.19 -165.0 0.16 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.196 -0.315 . . . . 0.0 110.884 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.3 tp -167.55 134.95 2.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.666 0.27 . . . . 0.0 110.889 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 35.6 t -72.96 128.64 36.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.696 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.2 p -111.19 127.78 55.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.066 0.46 . . . . 0.0 110.71 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.02 65.32 0.63 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.541 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 20.2 pt -70.29 47.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.189 -178.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 61.33 25.35 15.33 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.231 0.612 . . . . 0.0 112.649 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 16.3 m-85 -132.08 132.55 43.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 0.0 110.202 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 34.3 t80 -92.59 125.93 53.97 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.367 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.457 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.4 Cg_endo -93.41 179.6 10.3 Favored 'Cis proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.945 -1.273 . . . . 0.0 112.133 -0.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.4 m -78.17 163.5 25.77 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 p -144.6 136.55 25.97 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.393 -0.523 . . . . 0.0 112.234 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.6 m -70.65 131.36 43.8 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.167 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -119.61 153.06 54.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.526 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 27.1 Cg_exo -57.93 153.93 41.53 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.251 1.968 . . . . 0.0 110.181 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 0.9 OUTLIER -77.38 120.5 22.47 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.927 -178.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.17 -27.45 2.41 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.559 -0.734 . . . . 0.0 109.174 178.359 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.488 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 7.5 mtmp? . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.4 p -151.61 153.62 34.84 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.048 0.452 . . . . 0.0 110.37 178.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -83.6 129.08 34.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.855 -178.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.519 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.83 -162.74 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.532 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.84 129.36 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.206 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.01 40.21 9.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.682 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.27 135.35 45.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.261 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 140.41 57.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.285 0.564 . . . . 0.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.0 m -101.54 149.05 24.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.276 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.7 m -79.11 130.45 69.47 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.95 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.451 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 32.9 Cg_endo -64.29 -53.83 1.01 Allowed 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 123.101 2.534 . . . . 0.0 114.162 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.451 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 22.0 m-90 -79.62 -50.21 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.628 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.3 p -171.12 141.0 1.59 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.796 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.93 -166.48 33.98 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.488 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 3.5 m-20 -68.95 142.15 54.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.922 0.391 . . . . 0.0 110.71 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.2 m -81.88 153.32 26.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.256 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 18.4 m -64.01 138.3 58.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.827 -0.169 . . . . 0.0 111.174 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.0 m -62.51 146.05 52.67 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -82.39 147.18 55.84 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.172 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.594 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.9 Cg_endo -98.0 36.79 6.66 Favored 'Cis proline' 0 N--CA 1.45 -1.087 0 C-N-CA 122.997 -1.668 . . . . 0.0 113.686 1.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.532 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 15.0 m-85 -77.8 147.28 35.33 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.032 0.444 . . . . 0.0 110.596 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -126.49 142.36 51.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.623 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.1 t -72.39 126.2 29.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.321 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -104.25 130.17 52.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.051 0.453 . . . . 0.0 110.958 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.5 m -114.51 65.79 0.67 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.39 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.737 HD11 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.49 43.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.749 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 62.81 22.29 13.31 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 123.103 0.561 . . . . 0.0 112.319 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -125.69 133.38 52.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.43 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 39.3 t80 -92.04 126.99 51.25 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.277 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.43 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.5 Cg_endo -95.36 179.89 8.28 Favored 'Cis proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.961 -1.266 . . . . 0.0 112.257 -0.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 63.4 m -78.13 159.48 28.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -146.87 135.54 22.09 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.543 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.623 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.9 m -67.84 130.02 41.71 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.777 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -126.68 154.11 75.64 Favored Pre-proline 0 C--N 1.323 -0.579 0 O-C-N 124.456 1.098 . . . . 0.0 108.919 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.514 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 46.7 Cg_exo -54.05 150.03 32.97 Favored 'Trans proline' 0 N--CA 1.465 -0.171 0 C-N-CA 122.648 2.232 . . . . 0.0 111.576 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 13.4 ttpp -77.92 68.1 3.91 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.234 0.54 . . . . 0.0 110.047 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.78 -5.75 2.57 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 . . . . . 0 C--O 1.251 1.18 0 CA-C-O 117.723 -1.132 . . . . 0.0 110.542 -179.414 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.489 ' HG3' ' CG ' ' A' ' 15' ' ' ASP . 1.9 ptmm? . . . . . 0 N--CA 1.486 1.345 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.524 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.0 p -137.09 163.2 31.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.968 0.413 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 8' ' ' ASP . 77.6 mt -102.11 127.32 49.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.484 -178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.25 -161.1 0.29 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.314 0.578 . . . . 0.0 112.456 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.575 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 10.3 pm0 -66.31 129.53 40.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.98 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.05 41.26 14.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.074 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -104.64 132.36 50.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.621 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.446 ' O ' HD13 ' A' ' 3' ' ' LEU . 7.7 t70 -57.87 134.81 56.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.593 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -127.55 137.66 52.68 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.966 0.889 . . . . 0.0 112.206 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.447 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 19.6 m -88.52 141.23 30.24 Favored Pre-proline 0 C--N 1.315 -0.926 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.782 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.55 -37.36 90.43 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 123.264 2.642 . . . . 0.0 113.494 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -135.95 -60.77 0.72 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.92 0.39 . . . . 0.0 111.384 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -76.72 66.14 2.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.751 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.447 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -162.8 151.85 21.8 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.727 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.489 ' CG ' ' HG3' ' A' ' 1' ' ' LYS . 21.6 m-20 -60.22 148.68 35.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.962 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.7 m -79.03 147.46 32.84 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.4 m -64.52 140.62 58.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.529 0.204 . . . . 0.0 111.194 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.4 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 36.8 m -63.01 143.56 57.66 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -80.45 147.81 64.78 Favored Pre-proline 0 C--N 1.308 -1.229 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.803 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.721 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 93.7 Cg_endo -97.55 34.53 8.66 Favored 'Cis proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.893 -1.711 . . . . 0.0 114.017 1.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.62 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 22.0 m-85 -76.13 161.59 28.71 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -141.8 140.46 33.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.2 t -67.59 132.5 47.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.857 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.3 p -119.5 128.66 54.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.298 0.57 . . . . 0.0 111.654 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 88.4 m -115.87 64.9 0.7 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.1 pt -69.81 48.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.39 20.74 9.05 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.032 0.533 . . . . 0.0 112.23 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.441 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -134.68 136.06 42.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.061 0.458 . . . . 0.0 110.019 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.55 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 43.4 t80 -90.79 134.42 30.54 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.488 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.55 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 60.9 Cg_endo -97.39 172.5 11.22 Favored 'Cis proline' 0 N--CA 1.453 -0.863 0 C-N-CA 124.236 -1.152 . . . . 0.0 113.106 0.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.5 m -79.08 146.21 33.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.3 137.36 21.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.109 -0.636 . . . . 0.0 112.272 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.3 m -66.5 129.94 41.53 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.624 ' HB2' ' CE3' ' A' ' 38' ' ' TRP . 21.5 mmt85 -119.7 160.68 41.34 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.62 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.8 Cg_endo -58.54 159.79 19.01 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.452 2.101 . . . . 0.0 111.569 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.721 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 51.9 tttp -77.97 77.76 4.47 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.692 0.758 . . . . 0.0 109.767 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.7 47.36 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.988 -178.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.624 ' CE3' ' HB2' ' A' ' 34' ' ' ARG . 3.4 p90 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.112 -0.947 . . . . 0.0 111.006 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -160.54 157.74 27.96 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.689 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.578 HD13 ' SG ' ' A' ' 33' ' ' CYS . 79.8 mt -79.24 134.62 36.65 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.904 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.39 -166.48 0.86 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.212 0.529 . . . . 0.0 112.403 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.735 ' HB2' ' HG3' ' A' ' 35' ' ' PRO . 1.8 pm0 -73.09 129.64 38.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.13 37.08 14.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.608 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.94 140.14 36.63 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.632 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.418 ' O ' HD12 ' A' ' 3' ' ' LEU . 2.5 p30 -62.9 148.73 46.45 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.138 0.494 . . . . 0.0 111.023 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -139.6 148.31 42.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.277 -179.601 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 9.4 m -79.68 130.59 67.11 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.06 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.443 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 48.2 Cg_endo -66.38 -48.35 2.49 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.299 2.666 . . . . 0.0 114.078 -178.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.443 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 15.7 m-90 -79.39 -51.99 8.67 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.5 m -160.95 137.05 8.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.134 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.19 -156.13 16.64 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.39 150.86 41.44 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.223 0.535 . . . . 0.0 110.657 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.1 m -85.7 145.73 27.15 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.403 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 9.1 m -73.89 140.51 45.73 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.1 m -61.71 143.11 56.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.76 142.02 65.06 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.773 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -101.46 41.34 3.62 Favored 'Cis proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.088 -1.213 . . . . 0.0 113.935 1.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.649 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 5.9 m-85 -78.25 147.65 34.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -127.17 136.94 52.78 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.7 t -67.52 124.85 24.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.993 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.5 p -110.18 126.81 54.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.101 0.477 . . . . 0.0 111.146 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 98.1 m -114.31 65.62 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.429 ' O ' HG12 ' A' ' 26' ' ' ILE . 16.3 tt -72.67 47.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.047 0.927 . . . . 0.0 112.358 -178.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 59.93 23.13 12.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.993 -1.003 . . . . 0.0 112.481 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -126.61 133.91 50.92 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.421 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 38.4 t80 -92.08 126.98 51.22 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.336 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.421 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 90.4 Cg_endo -95.49 -178.93 7.41 Favored 'Cis proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.363 -0.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.7 m -78.55 164.07 25.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.59 130.46 13.31 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.26 -0.576 . . . . 0.0 112.397 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.1 m -69.28 121.91 17.82 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.439 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 21.6 mmt180 -103.55 147.77 34.72 Favored Pre-proline 0 C--N 1.321 -0.656 0 O-C-N 123.926 0.766 . . . . 0.0 110.216 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.735 ' HG3' ' HB2' ' A' ' 5' ' ' GLU . 10.6 Cg_exo -63.32 147.28 93.79 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.53 2.153 . . . . 0.0 110.929 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HD3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -79.26 136.26 37.0 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 119.573 -0.851 . . . . 0.0 109.461 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.585 ' N ' ' HD3' ' A' ' 36' ' ' LYS . . . 142.01 -32.98 1.97 Allowed Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 106.847 -2.501 . . . . 0.0 106.847 -176.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 3.8 m-90 . . . . . 0 C--O 1.264 1.825 0 CA-C-N 113.26 -1.47 . . . . 0.0 107.567 176.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -160.7 160.86 31.97 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 123.507 0.504 . . . . 0.0 110.311 -179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -79.87 133.24 36.23 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.229 -179.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.21 -163.55 0.51 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.074 0.464 . . . . 0.0 112.212 -179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.583 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -72.64 131.53 42.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.327 0.584 . . . . 0.0 111.201 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.92 38.44 11.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.448 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.82 135.33 42.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.973 -179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.401 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 16.5 t70 -59.71 141.07 55.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.7 OUTLIER -139.42 138.47 36.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.951 0.882 . . . . 0.0 111.977 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.9 m -89.17 143.6 31.3 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.906 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.9 -37.29 77.36 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.623 2.882 . . . . 0.0 113.587 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 14.2 m-90 -133.73 -57.12 0.88 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.981 0.42 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.0 p -79.82 60.7 3.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.737 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -147.41 158.14 27.62 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.505 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.429 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 3.5 t0 -67.56 161.26 26.0 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.8 m -85.06 145.26 27.76 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.4 m -72.67 139.45 47.29 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.406 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 73.3 m -61.8 144.25 55.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.726 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.05 142.46 64.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.768 -178.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.48 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 90.6 Cg_endo -101.87 35.94 6.37 Favored 'Cis proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.298 -1.542 . . . . 0.0 113.677 0.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.594 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 10.0 m-85 -71.36 153.49 42.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.4 tp -133.03 138.91 46.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.603 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.6 t -68.5 122.48 18.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.646 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.5 p -101.99 126.07 48.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.116 0.484 . . . . 0.0 111.457 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 68.7 m -117.38 66.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.1 pt -70.37 46.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.74 21.37 10.15 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.012 0.525 . . . . 0.0 112.148 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.458 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 28.9 m-85 -136.27 138.21 41.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.073 0.463 . . . . 0.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.562 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 40.4 t80 -90.77 135.43 28.98 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.539 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.562 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.0 Cg_endo -97.97 170.53 11.22 Favored 'Cis proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.129 -1.196 . . . . 0.0 113.138 0.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.6 m -79.32 151.93 30.77 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.4 p -149.58 134.31 17.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.532 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.6 m -66.21 127.06 30.69 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.528 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 27.0 mmt180 -118.26 160.95 37.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 124.0 0.813 . . . . 0.0 109.25 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.594 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.7 Cg_endo -58.6 156.81 30.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.616 2.211 . . . . 0.0 111.676 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 47.8 tptt -77.74 115.36 17.43 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.88 47.24 2.12 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.417 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 4.7 p90 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.491 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.525 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 26.2 ttpp . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p -162.05 163.52 28.7 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.548 0.53 . . . . 0.0 109.893 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.616 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 91.4 mt -79.89 128.31 33.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.069 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.5 -162.3 0.4 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.201 0.524 . . . . 0.0 111.796 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.775 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -64.57 128.1 34.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.953 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HB2' ' NH1' ' A' ' 34' ' ' ARG . . . 63.27 47.63 3.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.628 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.616 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -115.87 126.22 53.67 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.118 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.507 ' O ' HD11 ' A' ' 3' ' ' LEU . 1.9 m-20 -54.32 128.26 30.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 112.068 -178.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -122.23 156.24 34.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.054 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.493 ' HB3' ' C ' ' A' ' 13' ' ' SER . 46.8 t -160.77 144.1 9.89 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.347 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -53.2 -33.13 63.3 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.65 2.9 . . . . 0.0 112.873 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -123.05 -48.9 1.98 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.944 0.402 . . . . 0.0 110.723 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.493 ' C ' ' HB3' ' A' ' 10' ' ' SER . 2.4 p -88.54 47.22 1.47 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.632 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -170.96 148.48 11.32 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.548 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.525 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 27.5 t0 -82.63 175.55 10.07 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -79.85 140.16 36.89 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.56 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.5 m -71.59 142.57 50.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.571 0.224 . . . . 0.0 110.78 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 94.0 m -68.22 143.84 55.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.676 ' HD3' ' H ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.83 144.23 59.59 Favored Pre-proline 0 C--N 1.312 -1.039 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.519 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 74.5 Cg_endo -103.18 38.94 4.34 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.785 -1.339 . . . . 0.0 113.688 1.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.775 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.9 m-85 -69.47 160.51 31.28 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.9 tp -125.04 134.79 52.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.872 0.368 . . . . 0.0 111.337 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.56 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 52.7 t -74.88 116.69 15.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.0 p -96.9 126.42 42.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.079 0.466 . . . . 0.0 111.457 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 83.3 m -117.63 66.59 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.118 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.453 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.1 tp -73.66 53.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 122.408 1.099 . . . . 0.0 112.408 -178.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.57 23.11 7.3 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.884 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.59 134.18 48.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.897 0.379 . . . . 0.0 110.153 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.468 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 42.5 t80 -92.26 128.55 44.56 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.936 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.468 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 72.6 Cg_endo -94.77 -179.29 8.18 Favored 'Cis proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.84 -1.317 . . . . 0.0 112.304 -0.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.1 m -79.25 171.82 14.66 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -153.42 129.96 10.69 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.261 -0.575 . . . . 0.0 111.855 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.31 127.5 33.17 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.414 ' NH1' ' HB2' ' A' ' 6' ' ' ALA . 27.9 mmt180 -120.0 147.2 43.91 Favored Pre-proline 0 C--N 1.319 -0.738 0 O-C-N 123.764 0.665 . . . . 0.0 109.302 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.553 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 34.6 Cg_exo -58.33 152.27 54.79 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.303 2.002 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.519 ' HE2' ' HB2' ' A' ' 20' ' ' PRO . 21.0 ttmm -77.57 122.54 25.41 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.785 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.11 -30.7 2.23 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.46 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 6.1 m-90 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.584 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.6 156.63 25.98 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.868 0.366 . . . . 0.0 110.17 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.637 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 82.6 mt -82.83 131.42 35.2 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.448 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.23 -161.97 0.36 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.498 ' OE2' ' HD3' ' A' ' 35' ' ' PRO . 16.7 tp10 -68.2 134.77 50.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.273 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.42 49.16 13.41 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.308 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -117.59 124.08 47.77 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.134 -0.626 . . . . 0.0 112.069 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.431 ' O ' HD13 ' A' ' 3' ' ' LEU . 75.6 m-20 -54.59 126.17 22.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.246 0.545 . . . . 0.0 111.183 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.89 154.65 24.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.136 -178.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 27.7 t -137.09 136.77 21.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.749 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.2 -30.5 71.69 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 123.463 2.775 . . . . 0.0 113.607 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 14.0 m-90 -132.73 -48.34 0.88 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.3 t -83.25 52.24 2.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.504 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.45 147.26 7.52 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.824 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.49 160.53 24.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.902 0.382 . . . . 0.0 110.456 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -78.9 148.82 32.59 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 22.1 m -65.1 136.43 56.72 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.434 0.159 . . . . 0.0 111.309 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.9 m -61.4 141.67 57.48 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.59 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 25.9 mmmt -79.8 151.28 73.62 Favored Pre-proline 0 C--N 1.308 -1.204 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.248 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.59 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 88.6 Cg_endo -94.38 30.21 14.27 Favored 'Cis proline' 0 N--CA 1.452 -0.969 0 C-N-CA 122.808 -1.747 . . . . 0.0 114.022 1.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 27.8 m-85 -71.12 163.69 27.11 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.698 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 tp -139.85 142.3 36.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 43.8 t -69.61 129.09 38.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.727 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.6 p -114.51 127.93 56.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.145 0.497 . . . . 0.0 111.365 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 96.7 m -113.76 66.24 0.66 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.35 -0.841 . . . . 0.0 108.777 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.421 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.0 pt -69.84 47.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.04 22.79 11.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.514 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.421 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.1 m-85 -133.55 135.64 44.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.911 0.386 . . . . 0.0 109.98 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.484 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 36.0 t80 -91.53 130.22 40.08 Favored Pre-proline 0 C--N 1.315 -0.908 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.914 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.484 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 57.6 Cg_endo -96.92 178.05 8.25 Favored 'Cis proline' 0 N--CA 1.451 -1.008 0 C-N-CA 124.202 -1.166 . . . . 0.0 112.734 -0.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.5 m -79.48 151.51 30.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.413 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -144.3 138.4 27.88 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.734 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.3 m -67.58 133.66 49.82 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.595 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.0 mmt85 -130.72 169.07 14.55 Favored Pre-proline 0 C--O 1.236 0.387 0 O-C-N 125.193 1.558 . . . . 0.0 107.776 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.595 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 29.6 Cg_endo -63.09 157.96 46.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 121.931 1.754 . . . . 0.0 111.85 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 48.9 tttm -78.25 72.17 4.77 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.802 0.81 . . . . 0.0 109.829 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.61 46.66 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.917 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.562 ' CE3' ' HB2' ' A' ' 34' ' ' ARG . 4.8 p90 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.3 tptm . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -162.84 161.53 26.05 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.372 0.42 . . . . 0.0 110.361 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 89.2 mt -79.99 136.82 36.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.648 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.03 -163.22 0.46 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.329 0.585 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.595 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 36.1 tt0 -74.74 133.26 42.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.533 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.95 43.54 9.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.14 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.564 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.88 137.64 45.53 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.381 -178.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.52 ' O ' HD11 ' A' ' 3' ' ' LEU . 10.0 t70 -59.73 135.31 57.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.192 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -126.31 141.43 51.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.766 0.793 . . . . 0.0 112.485 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.444 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 46.9 t -160.24 137.51 6.87 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.018 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.7 Cg_exo -62.19 -49.34 6.43 Favored 'Trans proline' 0 N--CA 1.472 0.247 0 C-N-CA 122.941 2.428 . . . . 0.0 113.59 -178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -102.08 10.71 39.29 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.671 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.8 m -156.03 51.77 0.55 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.117 0.484 . . . . 0.0 110.947 -179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.88 -133.02 1.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -166.26 -174.07 2.78 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -90.21 137.44 32.34 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 20.9 m -69.5 138.03 53.03 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.918 -0.128 . . . . 0.0 111.029 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.0 m -62.96 142.88 58.18 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -80.38 149.04 68.1 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.447 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.446 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 90.5 Cg_endo -96.36 37.64 6.1 Favored 'Cis proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.061 -1.641 . . . . 0.0 113.646 1.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.583 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 7.0 m-85 -77.13 148.91 35.75 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.169 0.509 . . . . 0.0 110.928 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 tp -126.76 140.73 52.16 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.292 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.9 t -69.65 121.92 18.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.867 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -96.76 122.64 39.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.3 m -121.22 59.22 0.95 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.593 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.1 pt -71.27 46.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 59.44 20.63 9.0 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.004 0.522 . . . . 0.0 111.996 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.17 136.01 50.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.063 0.459 . . . . 0.0 109.937 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.532 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 46.0 t80 -91.08 132.81 33.24 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.529 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.532 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 90.5 Cg_endo -99.05 172.05 9.24 Favored 'Cis proline' 0 N--CA 1.453 -0.859 0 C-N-CA 124.372 -1.095 . . . . 0.0 113.128 -0.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.4 m -79.25 149.08 31.97 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -150.92 134.52 16.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.769 -0.772 . . . . 0.0 112.622 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -64.58 127.95 33.71 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.489 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.0 mmt180 -120.01 159.47 46.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.432 1.082 . . . . 0.0 109.418 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.595 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 23.0 Cg_endo -62.43 152.68 75.68 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.376 2.051 . . . . 0.0 111.187 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 55.4 tttm -77.63 119.01 20.59 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.003 0.43 . . . . 0.0 110.125 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.61 -28.97 2.28 Favored Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.568 178.975 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.3 p -160.35 156.05 25.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.924 0.392 . . . . 0.0 110.327 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.572 HD11 ' HA ' ' A' ' 9' ' ' CYS . 78.5 mt -80.64 126.14 30.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.16 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.18 -164.99 0.69 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.038 0.446 . . . . 0.0 111.86 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.571 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.7 pm0 -68.42 129.85 41.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.303 0.573 . . . . 0.0 111.235 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.9 40.37 5.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.91 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -110.05 124.46 51.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.596 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -62.29 130.03 43.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.431 0.634 . . . . 0.0 111.543 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.572 ' HA ' HD11 ' A' ' 3' ' ' LEU . 2.8 m -81.2 154.3 26.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.79 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.7 m -79.05 128.2 77.04 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.915 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.462 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.6 Cg_endo -64.12 -53.86 1.05 Allowed 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 123.114 2.542 . . . . 0.0 113.738 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.462 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.8 m-90 -79.92 -51.78 8.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.69 0.281 . . . . 0.0 111.172 -179.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.8 t -176.97 148.49 0.64 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.576 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.26 -148.4 9.89 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.843 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.92 145.29 42.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.373 0.606 . . . . 0.0 111.149 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -90.06 155.89 18.76 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.642 178.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.6 m -65.63 139.54 58.43 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 121.33 -0.148 . . . . 0.0 110.77 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 57.6 m -65.38 146.65 54.63 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -79.55 140.43 55.61 Favored Pre-proline 0 C--N 1.31 -1.12 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -102.2 42.48 3.12 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.413 -1.078 . . . . 0.0 113.543 0.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.731 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -79.69 143.65 34.41 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.8 tp -120.66 139.36 53.13 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.921 0.391 . . . . 0.0 112.019 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.5 t -71.57 124.54 24.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.768 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -103.34 129.0 50.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.013 0.435 . . . . 0.0 111.294 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.4 m -115.88 65.91 0.7 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.256 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.802 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.76 43.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.574 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 61.91 21.75 12.52 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 122.978 0.511 . . . . 0.0 112.067 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -127.45 136.05 51.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.432 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 41.9 t80 -91.42 128.24 47.65 Favored Pre-proline 0 C--N 1.316 -0.853 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.087 179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.0 Cg_endo -97.71 178.26 7.54 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 124.134 -1.194 . . . . 0.0 112.708 -0.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 69.7 m -79.46 149.24 31.62 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -139.95 138.17 35.34 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.398 -0.521 . . . . 0.0 112.143 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.7 m -69.49 130.8 43.48 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -117.71 153.49 50.7 Favored Pre-proline 0 C--N 1.321 -0.667 0 O-C-N 123.799 0.687 . . . . 0.0 109.257 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.731 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.2 Cg_endo -63.18 154.58 66.73 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.335 2.023 . . . . 0.0 111.566 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -77.09 113.06 14.41 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.49 -27.53 2.36 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.643 178.895 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 23.9 p -160.96 159.7 29.85 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.212 0.32 . . . . 0.0 110.142 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.593 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 75.0 mt -80.68 126.31 31.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.699 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.34 -159.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.136 0.493 . . . . 0.0 112.104 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.646 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.8 128.12 34.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.269 0.557 . . . . 0.0 111.241 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.25 39.1 7.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.484 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.593 ' HB2' ' HB3' ' A' ' 3' ' ' LEU . . . -100.34 132.39 45.74 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.485 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 49.5 t0 -61.87 132.96 54.76 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.521 0.513 . . . . 0.0 110.671 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.505 ' HA ' HD13 ' A' ' 3' ' ' LEU . 4.0 m -92.98 153.65 18.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.169 0.509 . . . . 0.0 110.861 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.6 m -79.34 128.1 76.61 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.021 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.428 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 18.2 Cg_endo -60.87 -57.28 0.67 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.185 2.59 . . . . 0.0 113.832 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.428 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 16.0 m-90 -80.31 -52.55 7.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.081 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 t -176.93 147.9 0.61 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.245 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.86 -141.61 6.29 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.121 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -65.6 142.39 58.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.365 0.602 . . . . 0.0 111.365 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 m -97.62 150.93 20.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.527 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 35.1 m -64.69 140.79 58.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.408 0.147 . . . . 0.0 111.121 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -65.83 145.74 55.59 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.79 140.23 58.54 Favored Pre-proline 0 C--N 1.309 -1.153 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.956 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.54 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 95.8 Cg_endo -102.29 38.13 5.01 Favored 'Cis proline' 0 N--CA 1.455 -0.773 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.403 0.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.646 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.2 m-85 -70.73 145.69 50.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 110.097 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 tp -123.82 139.68 53.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.036 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 40.2 t -70.47 125.62 27.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.069 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.5 p -100.15 128.64 46.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.021 0.438 . . . . 0.0 111.286 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 45.8 m -120.09 69.0 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.79 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 15.6 pt -70.57 46.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.73 21.23 10.0 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.147 0.579 . . . . 0.0 112.132 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 64.9 m-85 -144.41 140.3 28.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.221 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.694 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 30.0 t80 -90.45 142.62 28.34 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.694 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.4 Cg_endo -94.59 157.97 16.51 Favored 'Cis proline' 0 N--CA 1.455 -0.74 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.626 0.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.9 m -78.73 139.62 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.26 140.08 37.57 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.72 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.626 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.7 m -65.23 131.24 45.99 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.697 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.7 mmt85 -124.82 152.11 69.23 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.0 0.813 . . . . 0.0 109.435 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.447 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 45.9 Cg_exo -55.07 143.73 72.5 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.789 2.326 . . . . 0.0 112.114 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 26.8 tptp -78.93 66.09 4.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.564 0.697 . . . . 0.0 110.253 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.6 45.22 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.42 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 7.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.601 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.62 ' HZ3' ' CG ' ' A' ' 15' ' ' ASP . 6.6 tmtt? . . . . . 0 N--CA 1.483 1.187 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p -162.36 161.63 27.5 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.505 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.464 HD11 ' O ' ' A' ' 8' ' ' ASP . 90.8 mt -79.41 136.62 37.01 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.437 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.53 -169.06 1.55 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -71.56 134.17 46.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.26 40.77 24.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.481 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.71 145.73 30.71 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.986 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.464 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.2 p30 -65.15 151.69 45.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.99 0.424 . . . . 0.0 110.594 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.448 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 7.6 p -158.03 -176.04 5.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.783 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.7 m -157.87 146.44 14.35 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.352 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -50.32 -37.17 49.67 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.84 3.027 . . . . 0.0 113.587 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.4 m-90 -128.61 -50.05 1.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.924 0.392 . . . . 0.0 110.914 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -79.67 56.83 2.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.33 155.26 26.5 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.183 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.62 ' CG ' ' HZ3' ' A' ' 1' ' ' LYS . 13.7 t0 -74.13 168.19 20.06 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.9 m -79.44 141.29 36.93 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.593 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 29.9 m -74.74 142.43 44.36 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -63.0 145.93 54.32 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.493 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -77.82 141.78 64.44 Favored Pre-proline 0 C--N 1.312 -1.038 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.599 -178.867 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.568 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 89.1 Cg_endo -102.68 39.02 4.46 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.17 -1.179 . . . . 0.0 113.941 1.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.78 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 55.3 m-85 -77.13 146.06 37.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 0.0 110.744 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -119.71 137.43 53.93 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.495 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.593 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 53.5 t -71.83 115.33 10.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.701 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.5 p -95.99 127.13 41.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.058 0.456 . . . . 0.0 110.964 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 95.4 m -116.52 69.92 0.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.443 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.4 pt -69.07 48.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 61.39 22.45 12.84 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.443 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 63.0 m-85 -140.48 131.37 26.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.008 0.433 . . . . 0.0 110.235 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.557 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 5.9 t80 -92.09 136.54 25.83 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.822 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.557 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 96.3 Cg_endo -88.19 170.39 35.06 Favored 'Cis proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.667 -1.389 . . . . 0.0 112.625 -0.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.2 m -78.91 178.5 7.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.6 p -156.27 128.38 7.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.299 -0.56 . . . . 0.0 112.282 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.5 m -69.4 124.42 23.83 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.474 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 31.9 mmt180 -118.58 158.8 46.23 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.027 0.829 . . . . 0.0 109.714 -179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.78 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 19.4 Cg_endo -60.03 148.7 88.11 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.523 2.149 . . . . 0.0 112.138 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.568 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 27.5 ttpt -78.66 76.15 5.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.105 0.479 . . . . 0.0 110.216 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.35 40.43 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.141 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.528 ' HB2' ' HG2' ' A' ' 35' ' ' PRO . 53.3 t-105 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.475 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.453 ' HZ1' ' CG ' ' A' ' 15' ' ' ASP . 3.8 ptpt . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 16' ' ' SER . 22.3 p -161.35 154.86 21.64 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 123.33 0.394 . . . . 0.0 109.997 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.468 HD12 ' O ' ' A' ' 8' ' ' ASP . 89.6 mt -82.5 132.05 35.21 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.2 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.69 -165.74 0.77 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 0.0 111.633 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.506 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 5.8 pt-20 -76.31 138.52 40.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.297 0.57 . . . . 0.0 111.14 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 63.31 39.48 9.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.964 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.82 138.74 45.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.011 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.468 ' O ' HD12 ' A' ' 3' ' ' LEU . 25.9 t70 -57.34 141.49 46.83 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.39 0.431 . . . . 0.0 110.488 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.42 ' HB3' HD13 ' A' ' 3' ' ' LEU . 17.0 p -156.27 -178.34 7.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.55 0.69 . . . . 0.0 111.94 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.1 m -154.82 145.9 16.5 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.094 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -50.71 -37.98 55.17 Favored 'Trans proline' 0 CA--C 1.53 0.324 0 C-N-CA 123.95 3.1 . . . . 0.0 113.86 -178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -129.97 -51.01 1.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.867 0.365 . . . . 0.0 111.196 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -78.44 58.39 2.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.742 -179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -170.81 154.06 22.09 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.589 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.453 ' CG ' ' HZ1' ' A' ' 1' ' ' LYS . 43.4 m-20 -63.13 157.11 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.051 0.453 . . . . 0.0 110.858 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 2.3 m -79.09 141.46 37.32 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.297 -0.41 . . . . 0.0 109.98 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.2 m -76.29 144.68 40.12 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.353 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -63.93 148.72 48.85 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -79.12 141.82 58.68 Favored Pre-proline 0 C--N 1.31 -1.118 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.42 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 88.0 Cg_endo -101.57 35.53 6.74 Favored 'Cis proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.995 -1.252 . . . . 0.0 113.599 0.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.867 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 25.6 m-85 -74.12 155.27 38.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -134.15 138.69 45.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.866 0.365 . . . . 0.0 111.689 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 49.9 t -68.85 120.81 15.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.576 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.3 p -102.05 124.72 48.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.279 0.561 . . . . 0.0 111.682 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 61.6 m -119.54 56.54 0.93 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.601 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.2 pt -71.49 46.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 61.28 19.02 9.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.944 0.498 . . . . 0.0 112.08 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -120.9 131.92 54.66 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 50.0 t80 -91.63 129.03 44.09 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.127 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 91.6 Cg_endo -97.28 178.71 7.63 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.16 -1.183 . . . . 0.0 112.453 -0.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 75.4 m -78.86 151.06 32.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -149.77 134.75 17.91 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.979 -0.689 . . . . 0.0 112.247 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.2 m -67.66 130.59 43.5 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -122.3 151.42 59.11 Favored Pre-proline 0 C--N 1.32 -0.684 0 O-C-N 124.175 0.922 . . . . 0.0 110.076 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.867 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 38.4 Cg_exo -57.65 146.46 84.77 Favored 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 122.393 2.062 . . . . 0.0 110.48 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 20' ' ' PRO . 23.2 ttmt -77.73 124.96 28.62 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.947 -179.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -29.35 2.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 5.3 m-90 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.488 -0.767 . . . . 0.0 109.503 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.8 p -160.98 157.51 26.46 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.475 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 80.2 mt -79.61 135.45 36.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.983 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.45 -166.82 0.92 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.174 0.511 . . . . 0.0 112.363 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 1.7 pm0 -73.78 132.36 42.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.058 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.73 38.37 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.544 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.85 141.46 36.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.454 ' O ' HD11 ' A' ' 3' ' ' LEU . 2.3 p30 -64.93 148.85 50.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.111 0.481 . . . . 0.0 110.894 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.475 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -142.53 149.32 38.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 111.099 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.7 m -79.82 131.21 64.54 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.081 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 52.4 Cg_endo -67.37 -47.27 2.28 Favored 'Trans proline' 0 N--CA 1.473 0.31 0 C-N-CA 123.386 2.724 . . . . 0.0 113.962 -178.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.48 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 15.9 m-90 -79.34 -51.58 9.23 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.591 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.2 m -161.42 135.09 6.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.024 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.67 -160.7 24.72 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -70.16 146.25 50.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.009 0.433 . . . . 0.0 110.775 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -81.88 145.53 30.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.287 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 13.2 m -75.24 142.91 43.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.1 m -63.23 143.62 57.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.5 mtmt -78.14 144.45 67.22 Favored Pre-proline 0 C--N 1.313 -1.018 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.139 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.57 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.8 Cg_endo -101.19 40.09 4.31 Favored 'Cis proline' 0 N--CA 1.451 -0.989 0 C-N-CA 123.473 -1.47 . . . . 0.0 113.706 1.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.67 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 7.8 m-85 -77.48 145.03 37.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.894 0.378 . . . . 0.0 110.435 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.7 tp -120.23 137.54 54.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -71.27 120.77 17.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.883 179.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.4 p -103.88 129.04 51.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.05 0.452 . . . . 0.0 111.037 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.6 m -114.84 66.98 0.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.6 pt -70.28 47.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.91 22.06 12.24 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -129.71 133.26 46.95 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.481 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.2 t80 -92.38 128.6 44.11 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.171 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.481 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 91.4 Cg_endo -93.32 -177.89 8.18 Favored 'Cis proline' 0 N--CA 1.451 -1.016 0 C-N-CA 123.713 -1.369 . . . . 0.0 112.197 -0.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -78.55 171.56 14.94 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.7 p -152.95 128.93 10.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.6 m -69.3 127.13 31.95 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -117.63 149.65 45.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 124.038 0.836 . . . . 0.0 110.119 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.67 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.9 Cg_exo -57.93 144.53 93.99 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.898 2.399 . . . . 0.0 111.814 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 43.1 tttm -78.86 68.97 4.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.541 0.686 . . . . 0.0 110.474 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.67 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.767 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.438 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 7.8 p90 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.462 -179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.0 mttp . . . . . 0 N--CA 1.486 1.351 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.1 p -77.15 144.25 38.53 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 118.521 -1.272 . . . . 0.0 111.715 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.505 HD11 ' SG ' ' A' ' 33' ' ' CYS . 91.6 mt -79.61 130.1 35.07 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.62 -1.627 . . . . 0.0 111.065 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.36 -164.05 0.58 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.224 0.535 . . . . 0.0 112.203 -179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -66.62 128.31 35.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.972 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.74 37.33 7.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.333 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -98.86 128.32 45.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.923 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -67.88 153.81 42.93 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.29 0.567 . . . . 0.0 111.902 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 4.0 p -151.55 -169.77 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.634 179.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.567 ' HB3' ' O ' ' A' ' 13' ' ' SER . 34.4 t -159.96 131.2 3.88 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.059 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.449 ' HD2' ' CE3' ' A' ' 12' ' ' TRP . 36.5 Cg_exo -64.4 -27.53 62.83 Favored 'Trans proline' 0 N--CA 1.471 0.151 0 C-N-CA 123.364 2.709 . . . . 0.0 112.309 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.449 ' CE3' ' HD2' ' A' ' 11' ' ' PRO . 30.2 m-90 -79.03 -24.05 43.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.521 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.567 ' O ' ' HB3' ' A' ' 10' ' ' SER . 9.8 t -176.99 125.57 0.15 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.482 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.18 150.23 6.49 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.867 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.89 161.86 25.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.908 0.385 . . . . 0.0 110.253 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.63 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.8 m -79.83 145.69 32.64 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.409 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.4 m -73.37 146.83 44.88 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.19 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.413 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 63.3 m -63.02 140.59 58.89 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -77.99 141.78 63.67 Favored Pre-proline 0 C--N 1.312 -1.036 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.807 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -101.28 45.55 2.58 Favored 'Cis proline' 0 CA--C 1.538 0.712 0 C-N-CA 124.171 -1.179 . . . . 0.0 114.052 1.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.578 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 4.7 m-30 -79.47 148.46 31.88 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -128.29 134.79 49.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.131 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 2.5 t -75.19 116.56 16.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.462 0.648 . . . . 0.0 109.95 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.4 p -84.86 123.25 30.25 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.472 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.3 m -112.69 64.82 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.055 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.452 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.2 pt -70.93 47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 61.67 21.11 11.9 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.103 0.561 . . . . 0.0 112.417 178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.452 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -133.46 132.69 41.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.042 0.448 . . . . 0.0 109.892 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.582 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 12.6 t80 -91.83 133.62 30.4 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.895 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.582 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.91 174.14 15.44 Favored 'Cis proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.936 -1.277 . . . . 0.0 112.677 -0.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.465 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 57.3 m -79.1 164.24 24.45 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -147.46 124.61 11.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.96 -0.696 . . . . 0.0 112.678 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.675 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.3 m -65.48 124.59 22.7 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.832 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -111.01 149.31 40.26 Favored Pre-proline 0 C--N 1.318 -0.782 0 O-C-N 124.135 0.897 . . . . 0.0 108.849 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.578 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 27.5 Cg_endo -64.56 150.38 88.32 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.553 2.168 . . . . 0.0 110.408 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.476 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 27.3 tptt -78.64 145.24 34.76 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.258 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.36 -33.59 1.89 Allowed Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 107.949 -2.06 . . . . 0.0 107.949 -177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 . . . . . 0 C--O 1.26 1.619 0 CA-C-O 117.734 -1.127 . . . . 0.0 108.229 177.043 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.4 tttm . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 p -160.88 165.89 29.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.983 0.42 . . . . 0.0 110.513 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.591 HD11 ' O ' ' A' ' 8' ' ' ASP . 81.2 mt -86.07 133.53 33.89 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.677 -178.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.483 ' HB2' ' OE2' ' A' ' 5' ' ' GLU . . . -79.53 -161.32 0.32 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.806 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -73.87 130.08 39.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.247 0.546 . . . . 0.0 111.395 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.26 38.9 7.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.736 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 3' ' ' LEU . . . -101.17 137.32 39.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.959 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.591 ' O ' HD11 ' A' ' 3' ' ' LEU . 3.7 p30 -61.32 142.95 56.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 110.946 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.8 p -144.38 163.32 34.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.46 0.648 . . . . 0.0 111.503 -178.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.426 ' HB3' ' C ' ' A' ' 13' ' ' SER . 35.4 t -152.6 142.49 14.94 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.858 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.19 -36.34 55.65 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.927 3.085 . . . . 0.0 113.5 -178.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -123.66 -49.65 1.88 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.043 0.449 . . . . 0.0 110.759 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.426 ' C ' ' HB3' ' A' ' 10' ' ' SER . 12.2 m -86.96 52.76 2.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.114 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.79 149.89 18.26 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.516 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.475 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 37.4 t0 -73.56 165.56 24.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -80.66 142.53 33.86 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 33.4 m -72.52 139.97 47.9 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.8 m -63.2 146.0 54.3 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.58 139.74 59.11 Favored Pre-proline 0 C--N 1.311 -1.07 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.636 -179.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -103.95 37.2 4.87 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.844 -1.315 . . . . 0.0 113.686 1.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.663 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 4.9 m-85 -66.73 156.56 35.04 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.397 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.4 tp -130.79 134.96 47.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.785 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.6 t -70.06 120.57 15.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.767 -0.652 . . . . 0.0 109.674 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.3 p -101.4 121.08 41.27 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.099 0.476 . . . . 0.0 111.666 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.3 m -112.12 62.57 0.62 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.457 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.0 tp -74.25 54.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 122.285 1.04 . . . . 0.0 112.445 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 55.95 23.46 6.67 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.373 -1.285 . . . . 0.0 112.897 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -128.77 133.62 48.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.019 0.438 . . . . 0.0 110.172 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 41.6 t80 -92.03 128.27 46.21 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.444 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.3 Cg_endo -95.69 179.61 8.22 Favored 'Cis proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.981 -1.258 . . . . 0.0 112.212 -0.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.82 162.04 26.37 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -147.67 129.87 15.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.431 -0.508 . . . . 0.0 112.263 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.5 m -69.0 127.53 33.47 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 36.4 mtt180 -116.85 160.19 37.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 123.768 0.667 . . . . 0.0 110.013 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.543 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 19.6 Cg_endo -62.95 150.55 88.2 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.284 1.99 . . . . 0.0 111.352 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.1 tptm -79.31 128.09 32.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.936 0.398 . . . . 0.0 110.481 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.21 50.21 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -178.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 m0 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.759 -179.465 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.9 pttm . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.2 p -134.01 153.42 51.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.271 0.558 . . . . 0.0 111.066 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 90.5 mt -88.57 140.27 29.63 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.621 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.24 -177.07 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.052 0.453 . . . . 0.0 111.752 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.515 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.4 pt-20 -71.8 140.01 49.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.031 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 42.43 17.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.661 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.34 145.26 46.32 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.712 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -61.67 149.95 38.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.919 0.39 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.37 153.08 39.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.787 0.803 . . . . 0.0 111.995 -179.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 31.6 t -108.41 138.72 20.28 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 114.532 -1.213 . . . . 0.0 108.884 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.55 -34.11 88.77 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.197 2.598 . . . . 0.0 113.384 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -140.15 -50.26 0.47 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.952 0.406 . . . . 0.0 111.473 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 m -78.04 58.57 2.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.873 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.96 156.53 22.78 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.441 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.5 149.77 28.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.592 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.6 m -79.02 145.85 33.65 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 14.6 m -65.13 144.04 57.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.544 0.211 . . . . 0.0 111.121 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.2 m -64.01 141.51 58.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -79.49 149.11 71.33 Favored Pre-proline 0 C--N 1.31 -1.117 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.936 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 97.5 Cg_endo -96.71 34.4 8.89 Favored 'Cis proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.805 -1.748 . . . . 0.0 113.829 1.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.865 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 34.0 m-85 -77.94 145.17 36.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.872 0.367 . . . . 0.0 110.358 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -121.17 141.45 50.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.713 -178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.8 t -71.36 122.45 20.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.675 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -105.96 127.87 53.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 111.25 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.7 m -114.32 64.76 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 26' ' ' ILE . 9.9 tp -73.28 55.01 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.356 1.074 . . . . 0.0 112.484 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.11 23.67 7.15 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.366 -1.288 . . . . 0.0 112.992 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -127.91 132.95 49.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.991 0.424 . . . . 0.0 110.111 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.439 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 37.8 t80 -92.45 127.25 49.34 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.17 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.439 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.65 -177.7 7.81 Favored 'Cis proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.82 -1.325 . . . . 0.0 112.212 -0.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.15 165.18 24.27 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -149.51 131.97 15.7 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.487 -0.485 . . . . 0.0 112.037 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -70.18 132.37 45.68 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.505 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 30.1 mmt180 -126.74 160.63 57.71 Favored Pre-proline 0 C--N 1.322 -0.623 0 O-C-N 124.171 0.919 . . . . 0.0 109.016 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.865 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 18.8 Cg_endo -59.24 153.55 52.32 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.341 2.027 . . . . 0.0 111.17 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 88.1 tttt -77.3 116.46 17.93 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.818 -179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.79 45.74 1.88 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.128 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 5.5 p90 . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.129 -0.938 . . . . 0.0 110.382 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.3 p . . . . . 0 N--CA 1.449 -0.479 0 CA-C-O 120.872 0.368 . . . . 0.0 110.5 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.74 130.54 34.53 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.107 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.423 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.92 -166.4 0.9 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.112 0.482 . . . . 0.0 112.269 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.3 pm0 -70.98 134.69 47.36 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.468 0.651 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.18 38.8 10.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.623 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.92 47.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.638 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.5 139.05 57.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.259 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 C--N 1.326 -0.446 0 CA-C-O 121.95 0.881 . . . . 0.0 112.371 -179.869 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.1 m . . . . . 0 N--CA 1.445 -0.694 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 11.7 m -74.67 140.59 44.32 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 121.126 -0.23 . . . . 0.0 110.456 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.3 m -62.28 147.63 47.47 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -85.58 148.6 49.53 Favored Pre-proline 0 C--N 1.308 -1.213 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.22 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -95.55 32.76 10.65 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.895 -1.71 . . . . 0.0 113.684 1.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.75 ' HD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -75.32 145.5 41.72 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 tp -128.38 140.51 51.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.798 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.2 t -68.29 122.55 18.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.3 p -101.66 124.34 47.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.153 0.501 . . . . 0.0 111.26 -179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.2 m -119.48 66.25 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.549 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.439 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.3 pt -70.85 45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 59.6 21.34 9.94 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.011 0.524 . . . . 0.0 111.932 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 23.8 m-85 -135.32 139.31 44.22 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 61.1 t80 -90.67 134.95 29.73 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.392 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 81.0 Cg_endo -98.92 168.74 10.29 Favored 'Cis proline' 0 N--CA 1.454 -0.851 0 C-N-CA 124.348 -1.105 . . . . 0.0 113.159 0.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.0 m -79.49 151.44 30.79 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.48 134.39 16.79 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.385 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 6.9 m -67.41 130.04 41.82 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -119.91 156.07 54.61 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 123.858 0.724 . . . . 0.0 109.844 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.75 ' HA ' ' HD2' ' A' ' 21' ' ' TYR . 19.8 Cg_endo . . . . . 0 N--CA 1.462 -0.359 0 C-N-CA 122.458 2.105 . . . . 0.0 110.477 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 84.9 mt -79.68 126.13 30.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.69 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.55 -159.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.315 0.579 . . . . 0.0 112.503 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.802 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -65.88 127.61 32.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.095 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.53 42.22 11.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.941 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.79 120.7 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.791 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 58.1 m-20 -58.47 125.88 25.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.581 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 m . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.532 0.206 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.9 m -69.39 142.78 53.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.625 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -66.09 146.23 54.9 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.45 140.43 55.99 Favored Pre-proline 0 C--N 1.31 -1.113 0 C-N-CA 120.689 -0.405 . . . . 0.0 110.361 -179.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 91.2 Cg_endo -102.99 41.66 3.22 Favored 'Cis proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.399 -1.084 . . . . 0.0 113.553 1.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.802 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 1.7 m-85 -71.68 144.0 49.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -117.64 133.73 55.63 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.297 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.5 t -71.06 122.46 20.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.4 p -102.14 126.35 49.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.105 0.478 . . . . 0.0 111.726 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.0 m -114.3 64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.044 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.4 pt -71.21 45.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.67 20.93 10.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.071 0.548 . . . . 0.0 112.243 178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -128.81 135.38 49.06 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 31.6 t80 -91.52 129.98 40.94 Favored Pre-proline 0 C--N 1.316 -0.89 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.944 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 97.1 Cg_endo -97.18 178.51 7.81 Favored 'Cis proline' 0 N--CA 1.451 -1.013 0 C-N-CA 124.042 -1.232 . . . . 0.0 112.714 -0.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.1 m -79.62 149.89 31.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 1.4 p -138.96 135.63 34.56 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.49 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.0 m -67.0 127.08 31.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.503 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -112.56 146.0 34.1 Favored Pre-proline 0 C--N 1.321 -0.651 0 O-C-N 123.968 0.793 . . . . 0.0 109.936 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 20.5 Cg_exo . . . . . 0 N--CA 1.461 -0.438 0 C-N-CA 122.361 2.041 . . . . 0.0 110.248 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 p . . . . . 0 C--O 1.233 0.217 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.4 mt -79.52 127.54 32.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.502 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.17 -161.07 0.28 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.253 0.549 . . . . 0.0 111.844 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.684 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 4.5 pt-20 -73.15 132.65 43.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.511 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.39 40.99 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.26 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.17 132.85 52.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.74 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.01 132.24 50.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.959 0.409 . . . . 0.0 110.794 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.361 -179.883 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.552 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.6 m -66.18 137.8 57.25 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.7 m -62.92 156.86 23.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -97.26 150.18 36.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 C-N-CA 119.893 -0.723 . . . . 0.0 110.454 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.546 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 98.1 Cg_endo -93.92 35.26 7.87 Favored 'Cis proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.137 -1.61 . . . . 0.0 113.707 1.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 16.2 m-85 -68.47 154.93 40.9 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.856 0.36 . . . . 0.0 110.314 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -134.41 136.19 43.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.809 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -74.18 120.3 19.57 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -87.51 127.85 35.24 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.7 m -129.86 75.91 1.69 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.938 0.774 . . . . 0.0 109.145 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.7 pt -71.46 43.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 60.42 16.53 6.41 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.36 0.664 . . . . 0.0 112.081 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.399 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.743 ' CG ' ' HA ' ' A' ' 30' ' ' PRO . 6.7 t80 -80.44 151.77 72.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.743 ' HA ' ' CG ' ' A' ' 29' ' ' TYR . 10.8 Cg_endo -90.79 138.06 10.72 Favored 'Cis proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.599 -1.0 . . . . 0.0 114.192 1.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 67.9 m -79.25 139.29 37.93 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 177.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -145.01 140.03 27.88 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.213 -0.995 . . . . 0.0 113.099 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.3 129.18 39.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -117.23 151.03 47.31 Favored Pre-proline 0 C--N 1.323 -0.587 0 O-C-N 124.263 0.977 . . . . 0.0 109.662 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 16.5 Cg_exo . . . . . 0 C--N 1.345 0.348 0 C-N-CA 122.604 2.202 . . . . 0.0 110.907 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.1 p . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.528 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 61.8 mt -79.7 133.64 36.37 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.83 -164.59 0.61 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.393 0.616 . . . . 0.0 112.004 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.635 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 56.4 tt0 -70.65 132.68 45.79 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.176 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.47 49.17 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.168 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.42 129.94 52.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.756 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.9 m-20 -54.79 126.99 26.4 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.241 0.543 . . . . 0.0 111.821 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.319 179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.6 m -67.55 139.92 56.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.327 0.108 . . . . 0.0 110.964 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.2 m -65.16 138.99 58.62 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.43 149.41 72.01 Favored Pre-proline 0 C--N 1.31 -1.137 0 C-N-CA 120.286 -0.566 . . . . 0.0 110.454 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -96.44 37.74 6.04 Favored 'Cis proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.041 -1.65 . . . . 0.0 113.81 1.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 6.6 m-85 -74.55 146.53 42.55 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.108 0.48 . . . . 0.0 110.244 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.99 139.3 51.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.43 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 52.8 t -73.23 128.66 36.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.549 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.3 p -112.47 128.02 56.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.107 0.48 . . . . 0.0 111.481 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 86.6 m -111.87 67.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.424 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 18.0 pt -69.87 48.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.39 21.95 11.53 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.5 m-85 -132.91 133.26 43.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.1 t80 -91.92 130.32 38.9 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.008 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 37.7 Cg_endo -94.79 178.67 9.64 Favored 'Cis proline' 0 N--CA 1.448 -1.15 0 C-N-CA 123.927 -1.281 . . . . 0.0 112.566 -0.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 37.5 m -79.21 156.41 28.18 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.403 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -141.29 135.52 30.68 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.972 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -68.1 132.29 46.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.705 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -122.7 155.77 62.62 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.293 0.996 . . . . 0.0 108.997 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.635 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 18.9 Cg_endo . . . . . 0 N--CA 1.463 -0.308 0 C-N-CA 122.357 2.038 . . . . 0.0 110.388 178.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.7 p . . . . . 0 N--CA 1.446 -0.661 0 CA-C-O 120.955 0.407 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.562 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 55.9 mt -91.39 122.73 34.26 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.335 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.58 -160.25 0.25 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.278 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.666 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 3.9 pm0 -65.97 125.82 26.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.935 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.54 37.78 12.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -99.85 136.07 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -65.2 136.59 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.351 0.596 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.562 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 7.2 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.847 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 14.8 m . . . . . 0 N--CA 1.455 -0.219 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 36.6 m -59.83 139.01 57.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.564 0.221 . . . . 0.0 111.104 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.434 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 58.3 m -65.68 148.62 51.45 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.2 OUTLIER -79.72 139.52 54.43 Favored Pre-proline 0 C--N 1.311 -1.079 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.179 179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 62.9 Cg_endo -106.74 46.56 1.9 Allowed 'Cis proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.167 -1.18 . . . . 0.0 113.579 1.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.666 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 3.4 m-85 -72.19 -165.0 0.16 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.196 -0.315 . . . . 0.0 110.884 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.3 tp -167.55 134.95 2.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.666 0.27 . . . . 0.0 110.889 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 35.6 t -72.96 128.64 36.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.696 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.2 p -111.19 127.78 55.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.066 0.46 . . . . 0.0 110.71 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.02 65.32 0.63 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.541 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 20.2 pt -70.29 47.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.189 -178.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 61.33 25.35 15.33 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.231 0.612 . . . . 0.0 112.649 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 16.3 m-85 -132.08 132.55 43.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 0.0 110.202 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 34.3 t80 -92.59 125.93 53.97 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.367 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.4 Cg_endo -93.41 179.6 10.3 Favored 'Cis proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.945 -1.273 . . . . 0.0 112.133 -0.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 23' ' ' CYS . 34.4 m -78.17 163.5 25.77 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 p -144.6 136.55 25.97 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.393 -0.523 . . . . 0.0 112.234 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.6 m -70.65 131.36 43.8 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.167 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -119.61 153.06 54.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.503 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 27.1 Cg_exo . . . . . 0 N--CA 1.461 -0.42 0 C-N-CA 122.251 1.968 . . . . 0.0 110.181 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.4 p . . . . . 0 N--CA 1.445 -0.693 0 CA-C-O 121.048 0.452 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -83.6 129.08 34.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.855 -178.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.539 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.83 -162.74 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.541 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.84 129.36 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.206 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.01 40.21 9.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.682 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.421 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.27 135.35 45.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.261 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 140.41 57.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.285 0.564 . . . . 0.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.276 -179.38 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.436 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.2 m . . . . . 0 N--CA 1.452 -0.368 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 18.4 m -64.01 138.3 58.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.827 -0.169 . . . . 0.0 111.174 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.0 m -62.51 146.05 52.67 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -82.39 147.18 55.84 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.172 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -98.0 36.79 6.66 Favored 'Cis proline' 0 N--CA 1.45 -1.087 0 C-N-CA 122.997 -1.668 . . . . 0.0 113.686 1.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.541 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 15.0 m-85 -77.8 147.28 35.33 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.032 0.444 . . . . 0.0 110.596 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -126.49 142.36 51.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.1 t -72.39 126.2 29.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.321 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -104.25 130.17 52.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.051 0.453 . . . . 0.0 110.958 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.5 m -114.51 65.79 0.67 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.39 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.862 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.49 43.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.749 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 62.81 22.29 13.31 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 123.103 0.561 . . . . 0.0 112.319 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -125.69 133.38 52.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -92.04 126.99 51.25 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.277 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -95.36 179.89 8.28 Favored 'Cis proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.961 -1.266 . . . . 0.0 112.257 -0.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 63.4 m -78.13 159.48 28.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -146.87 135.54 22.09 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.543 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.9 m -67.84 130.02 41.71 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.777 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -126.68 154.11 75.64 Favored Pre-proline 0 C--N 1.323 -0.579 0 O-C-N 124.456 1.098 . . . . 0.0 108.919 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.492 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 46.7 Cg_exo . . . . . 0 N--CA 1.465 -0.171 0 C-N-CA 122.648 2.232 . . . . 0.0 111.576 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.0 p . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.968 0.413 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 77.6 mt -102.11 127.32 49.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.484 -178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.25 -161.1 0.29 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.314 0.578 . . . . 0.0 112.456 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.585 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 10.3 pm0 -66.31 129.53 40.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.98 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.05 41.26 14.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.074 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.64 132.36 50.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.621 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.87 134.81 56.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.593 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.512 -0.486 0 CA-C-O 121.966 0.889 . . . . 0.0 112.206 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.7 m . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.4 m -64.52 140.62 58.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.529 0.204 . . . . 0.0 111.194 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.8 m -63.01 143.56 57.66 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -80.45 147.81 64.78 Favored Pre-proline 0 C--N 1.308 -1.229 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.803 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -97.55 34.53 8.66 Favored 'Cis proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.893 -1.711 . . . . 0.0 114.017 1.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.597 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 22.0 m-85 -76.13 161.59 28.71 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -141.8 140.46 33.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.2 t -67.59 132.5 47.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.857 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.3 p -119.5 128.66 54.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.298 0.57 . . . . 0.0 111.654 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 88.4 m -115.87 64.9 0.7 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.1 pt -69.81 48.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.39 20.74 9.05 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.032 0.533 . . . . 0.0 112.23 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.441 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -134.68 136.06 42.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.061 0.458 . . . . 0.0 110.019 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 43.4 t80 -90.79 134.42 30.54 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.488 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 60.9 Cg_endo -97.39 172.5 11.22 Favored 'Cis proline' 0 N--CA 1.453 -0.863 0 C-N-CA 124.236 -1.152 . . . . 0.0 113.106 0.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.5 m -79.08 146.21 33.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.3 137.36 21.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.109 -0.636 . . . . 0.0 112.272 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.3 m -66.5 129.94 41.53 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.523 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 21.5 mmt85 -119.7 160.68 41.34 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.597 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.8 Cg_endo . . . . . 0 C--N 1.345 0.347 0 C-N-CA 122.452 2.101 . . . . 0.0 111.569 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.8 mt -79.24 134.62 36.65 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.904 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.465 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.39 -166.48 0.86 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.212 0.529 . . . . 0.0 112.403 -178.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.769 ' HB2' ' HG3' ' A' ' 35' ' ' PRO . 1.8 pm0 -73.09 129.64 38.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.13 37.08 14.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.608 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.94 140.14 36.63 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.632 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -62.9 148.73 46.45 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.138 0.494 . . . . 0.0 111.023 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.277 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.476 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 9.1 m -73.89 140.51 45.73 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.1 m -61.71 143.11 56.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.9 ptpt -77.76 142.02 65.06 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.773 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 85.5 Cg_endo -101.46 41.34 3.62 Favored 'Cis proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.088 -1.213 . . . . 0.0 113.935 1.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.665 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 5.9 m-85 -78.25 147.65 34.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -127.17 136.94 52.78 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.7 t -67.52 124.85 24.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.993 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.5 p -110.18 126.81 54.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.101 0.477 . . . . 0.0 111.146 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 98.1 m -114.31 65.62 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.442 ' O ' HG12 ' A' ' 26' ' ' ILE . 16.3 tt -72.67 47.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.047 0.927 . . . . 0.0 112.358 -178.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 59.93 23.13 12.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.993 -1.003 . . . . 0.0 112.481 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -126.61 133.91 50.92 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 38.4 t80 -92.08 126.98 51.22 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.336 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.4 Cg_endo -95.49 -178.93 7.41 Favored 'Cis proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.363 -0.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.7 m -78.55 164.07 25.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.59 130.46 13.31 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.26 -0.576 . . . . 0.0 112.397 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.1 m -69.28 121.91 17.82 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 21.6 mmt180 -103.55 147.77 34.72 Favored Pre-proline 0 C--N 1.321 -0.656 0 O-C-N 123.926 0.766 . . . . 0.0 110.216 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.769 ' HG3' ' HB2' ' A' ' 5' ' ' GLU . 10.6 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 122.53 2.153 . . . . 0.0 110.929 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.792 0.329 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -79.87 133.24 36.23 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.229 -179.006 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.507 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.21 -163.55 0.51 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.074 0.464 . . . . 0.0 112.212 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.592 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -72.64 131.53 42.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.327 0.584 . . . . 0.0 111.201 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.92 38.44 11.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.448 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.411 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.82 135.33 42.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.973 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 16.5 t70 -59.71 141.07 55.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 121.951 0.882 . . . . 0.0 111.977 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.448 -0.571 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.4 m -72.67 139.45 47.29 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.402 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 73.3 m -61.8 144.25 55.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.82 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.05 142.46 64.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.768 -178.762 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 90.6 Cg_endo -101.87 35.94 6.37 Favored 'Cis proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.298 -1.542 . . . . 0.0 113.677 0.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 10.0 m-85 -71.36 153.49 42.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.4 tp -133.03 138.91 46.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.603 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.6 t -68.5 122.48 18.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.646 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.5 p -101.99 126.07 48.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.116 0.484 . . . . 0.0 111.457 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 68.7 m -117.38 66.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.1 pt -70.37 46.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.74 21.37 10.15 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.012 0.525 . . . . 0.0 112.148 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.458 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 28.9 m-85 -136.27 138.21 41.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.073 0.463 . . . . 0.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 40.4 t80 -90.77 135.43 28.98 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.539 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.508 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.0 Cg_endo -97.97 170.53 11.22 Favored 'Cis proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.129 -1.196 . . . . 0.0 113.138 0.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.6 m -79.32 151.93 30.77 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.4 p -149.58 134.31 17.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.532 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.6 m -66.21 127.06 30.69 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.521 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 27.0 mmt180 -118.26 160.95 37.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 124.0 0.813 . . . . 0.0 109.25 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.7 Cg_endo . . . . . 0 C--N 1.345 0.357 0 C-N-CA 122.616 2.211 . . . . 0.0 111.676 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.4 mt -79.89 128.31 33.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.069 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.5 -162.3 0.4 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.201 0.524 . . . . 0.0 111.796 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.787 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -64.57 128.1 34.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.953 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.27 47.63 3.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.628 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.87 126.22 53.67 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.118 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.32 128.26 30.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 112.068 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.054 179.764 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.449 -0.49 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.5 m -71.59 142.57 50.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.571 0.224 . . . . 0.0 110.78 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 94.0 m -68.22 143.84 55.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.769 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.83 144.23 59.59 Favored Pre-proline 0 C--N 1.312 -1.039 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 74.5 Cg_endo -103.18 38.94 4.34 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.785 -1.339 . . . . 0.0 113.688 1.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.787 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.9 m-85 -69.47 160.51 31.28 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.9 tp -125.04 134.79 52.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.872 0.368 . . . . 0.0 111.337 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 52.7 t -74.88 116.69 15.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.0 p -96.9 126.42 42.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.079 0.466 . . . . 0.0 111.457 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 83.3 m -117.63 66.59 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.118 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.1 tp -73.66 53.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 122.408 1.099 . . . . 0.0 112.408 -178.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.57 23.11 7.3 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.884 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.59 134.18 48.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.897 0.379 . . . . 0.0 110.153 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 t80 -92.26 128.55 44.56 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.936 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 72.6 Cg_endo -94.77 -179.29 8.18 Favored 'Cis proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.84 -1.317 . . . . 0.0 112.304 -0.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.1 m -79.25 171.82 14.66 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -153.42 129.96 10.69 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.261 -0.575 . . . . 0.0 111.855 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.31 127.5 33.17 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -120.0 147.2 43.91 Favored Pre-proline 0 C--N 1.319 -0.738 0 O-C-N 123.764 0.665 . . . . 0.0 109.302 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.521 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 34.6 Cg_exo . . . . . 0 N--CA 1.461 -0.386 0 C-N-CA 122.303 2.002 . . . . 0.0 110.695 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 120.868 0.366 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -82.83 131.42 35.2 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.448 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.23 -161.97 0.36 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.523 ' OE2' ' HD3' ' A' ' 35' ' ' PRO . 16.7 tp10 -68.2 134.77 50.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.273 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.42 49.16 13.41 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.308 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.415 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -117.59 124.08 47.77 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.134 -0.626 . . . . 0.0 112.069 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.42 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 75.6 m-20 -54.59 126.17 22.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.246 0.545 . . . . 0.0 111.183 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 3' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.136 -178.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 22.1 m -65.1 136.43 56.72 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.434 0.159 . . . . 0.0 111.309 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.9 m -61.4 141.67 57.48 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.642 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 25.9 mmmt -79.8 151.28 73.62 Favored Pre-proline 0 C--N 1.308 -1.204 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.248 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.642 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 88.6 Cg_endo -94.38 30.21 14.27 Favored 'Cis proline' 0 N--CA 1.452 -0.969 0 C-N-CA 122.808 -1.747 . . . . 0.0 114.022 1.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 27.8 m-85 -71.12 163.69 27.11 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.698 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 tp -139.85 142.3 36.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 43.8 t -69.61 129.09 38.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.727 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.6 p -114.51 127.93 56.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.145 0.497 . . . . 0.0 111.365 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 96.7 m -113.76 66.24 0.66 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.35 -0.841 . . . . 0.0 108.777 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.0 pt -69.84 47.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.04 22.79 11.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.514 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.1 m-85 -133.55 135.64 44.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.911 0.386 . . . . 0.0 109.98 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 36.0 t80 -91.53 130.22 40.08 Favored Pre-proline 0 C--N 1.315 -0.908 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.914 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 57.6 Cg_endo -96.92 178.05 8.25 Favored 'Cis proline' 0 N--CA 1.451 -1.008 0 C-N-CA 124.202 -1.166 . . . . 0.0 112.734 -0.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.5 m -79.48 151.51 30.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.42 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -144.3 138.4 27.88 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.734 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.3 m -67.58 133.66 49.82 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.63 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.0 mmt85 -130.72 169.07 14.55 Favored Pre-proline 0 C--O 1.236 0.387 0 O-C-N 125.193 1.558 . . . . 0.0 107.776 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.63 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 29.6 Cg_endo . . . . . 0 C--N 1.349 0.6 0 C-N-CA 121.931 1.754 . . . . 0.0 111.85 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.648 0.261 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 89.2 mt -79.99 136.82 36.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.648 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.03 -163.22 0.46 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.329 0.585 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.608 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 36.1 tt0 -74.74 133.26 42.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.533 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.95 43.54 9.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.14 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.88 137.64 45.53 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.381 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.73 135.31 57.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.192 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 CA-C-O 121.766 0.793 . . . . 0.0 112.485 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.219 -0.545 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 20.9 m -69.5 138.03 53.03 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.918 -0.128 . . . . 0.0 111.029 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.0 m -62.96 142.88 58.18 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -80.38 149.04 68.1 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.447 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -96.36 37.64 6.1 Favored 'Cis proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.061 -1.641 . . . . 0.0 113.646 1.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.55 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 7.0 m-85 -77.13 148.91 35.75 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.169 0.509 . . . . 0.0 110.928 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 tp -126.76 140.73 52.16 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.292 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.9 t -69.65 121.92 18.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.867 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -96.76 122.64 39.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.3 m -121.22 59.22 0.95 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.593 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.1 pt -71.27 46.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 59.44 20.63 9.0 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.004 0.522 . . . . 0.0 111.996 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.17 136.01 50.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.063 0.459 . . . . 0.0 109.937 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.47 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 46.0 t80 -91.08 132.81 33.24 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.529 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.5 Cg_endo -99.05 172.05 9.24 Favored 'Cis proline' 0 N--CA 1.453 -0.859 0 C-N-CA 124.372 -1.095 . . . . 0.0 113.128 -0.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.4 m -79.25 149.08 31.97 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -150.92 134.52 16.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.769 -0.772 . . . . 0.0 112.622 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -64.58 127.95 33.71 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.0 mmt180 -120.01 159.47 46.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.432 1.082 . . . . 0.0 109.418 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 23.0 Cg_endo . . . . . 0 N--CA 1.461 -0.401 0 C-N-CA 122.376 2.051 . . . . 0.0 111.187 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.563 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 78.5 mt -80.64 126.14 30.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.16 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.437 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -79.18 -164.99 0.69 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.038 0.446 . . . . 0.0 111.86 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.7 pm0 -68.42 129.85 41.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.303 0.573 . . . . 0.0 111.235 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.9 40.37 5.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.91 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -110.05 124.46 51.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.596 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -62.29 130.03 43.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.431 0.634 . . . . 0.0 111.543 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.563 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.8 m . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.79 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.6 m -65.63 139.54 58.43 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 121.33 -0.148 . . . . 0.0 110.77 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.449 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 57.6 m -65.38 146.65 54.63 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -79.55 140.43 55.61 Favored Pre-proline 0 C--N 1.31 -1.12 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -102.2 42.48 3.12 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.413 -1.078 . . . . 0.0 113.543 0.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.704 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -79.69 143.65 34.41 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.8 tp -120.66 139.36 53.13 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.921 0.391 . . . . 0.0 112.019 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.5 t -71.57 124.54 24.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.768 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -103.34 129.0 50.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.013 0.435 . . . . 0.0 111.294 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.4 m -115.88 65.91 0.7 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.256 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.867 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.76 43.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.574 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 61.91 21.75 12.52 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 122.978 0.511 . . . . 0.0 112.067 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -127.45 136.05 51.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.9 t80 -91.42 128.24 47.65 Favored Pre-proline 0 C--N 1.316 -0.853 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.087 179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 87.0 Cg_endo -97.71 178.26 7.54 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 124.134 -1.194 . . . . 0.0 112.708 -0.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 69.7 m -79.46 149.24 31.62 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -139.95 138.17 35.34 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.398 -0.521 . . . . 0.0 112.143 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.7 m -69.49 130.8 43.48 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -117.71 153.49 50.7 Favored Pre-proline 0 C--N 1.321 -0.667 0 O-C-N 123.799 0.687 . . . . 0.0 109.257 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.704 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.2 Cg_endo . . . . . 0 N--CA 1.459 -0.542 0 C-N-CA 122.335 2.023 . . . . 0.0 111.566 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 23.9 p . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 75.0 mt -80.68 126.31 31.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.699 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.528 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.34 -159.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.136 0.493 . . . . 0.0 112.104 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.649 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.8 128.12 34.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.269 0.557 . . . . 0.0 111.241 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.25 39.1 7.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.484 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.34 132.39 45.74 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.51 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 49.5 t0 -61.87 132.96 54.76 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.521 0.513 . . . . 0.0 110.671 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 C--N 1.324 -0.519 0 CA-C-O 121.169 0.509 . . . . 0.0 110.861 -179.782 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 m . . . . . 0 N--CA 1.449 -0.476 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.536 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 35.1 m -64.69 140.79 58.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.408 0.147 . . . . 0.0 111.121 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -65.83 145.74 55.59 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.2 ptmt -78.79 140.23 58.54 Favored Pre-proline 0 C--N 1.309 -1.153 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.956 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.429 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 95.8 Cg_endo -102.29 38.13 5.01 Favored 'Cis proline' 0 N--CA 1.455 -0.773 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.403 0.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.649 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.2 m-85 -70.73 145.69 50.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 110.097 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 tp -123.82 139.68 53.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.036 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 40.2 t -70.47 125.62 27.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.069 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.5 p -100.15 128.64 46.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.021 0.438 . . . . 0.0 111.286 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 45.8 m -120.09 69.0 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.79 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 15.6 pt -70.57 46.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.73 21.23 10.0 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.147 0.579 . . . . 0.0 112.132 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 64.9 m-85 -144.41 140.3 28.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.221 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.672 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 30.0 t80 -90.45 142.62 28.34 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.672 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.4 Cg_endo -94.59 157.97 16.51 Favored 'Cis proline' 0 N--CA 1.455 -0.74 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.626 0.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.9 m -78.73 139.62 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.26 140.08 37.57 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.72 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.7 m -65.23 131.24 45.99 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.697 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.7 mmt85 -124.82 152.11 69.23 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.0 0.813 . . . . 0.0 109.435 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 45.9 Cg_exo . . . . . 0 C--N 1.344 0.311 0 C-N-CA 122.789 2.326 . . . . 0.0 112.114 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.47 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 90.8 mt -79.41 136.62 37.01 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.437 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.53 -169.06 1.55 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -71.56 134.17 46.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.26 40.77 24.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.481 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.71 145.73 30.71 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.986 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.2 p30 -65.15 151.69 45.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.99 0.424 . . . . 0.0 110.594 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.47 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 7.6 p . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.783 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.606 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 29.9 m -74.74 142.43 44.36 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -63.0 145.93 54.32 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -77.82 141.78 64.44 Favored Pre-proline 0 C--N 1.312 -1.038 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.599 -178.867 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 89.1 Cg_endo -102.68 39.02 4.46 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.17 -1.179 . . . . 0.0 113.941 1.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 55.3 m-85 -77.13 146.06 37.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 0.0 110.744 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -119.71 137.43 53.93 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.495 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 53.5 t -71.83 115.33 10.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.701 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.5 p -95.99 127.13 41.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.058 0.456 . . . . 0.0 110.964 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 95.4 m -116.52 69.92 0.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.444 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.4 pt -69.07 48.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 61.39 22.45 12.84 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.444 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 63.0 m-85 -140.48 131.37 26.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.008 0.433 . . . . 0.0 110.235 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.553 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 5.9 t80 -92.09 136.54 25.83 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.822 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 96.3 Cg_endo -88.19 170.39 35.06 Favored 'Cis proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.667 -1.389 . . . . 0.0 112.625 -0.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.2 m -78.91 178.5 7.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.6 p -156.27 128.38 7.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.299 -0.56 . . . . 0.0 112.282 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.5 m -69.4 124.42 23.83 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 31.9 mmt180 -118.58 158.8 46.23 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.027 0.829 . . . . 0.0 109.714 -179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 19.4 Cg_endo . . . . . 0 C--N 1.344 0.293 0 C-N-CA 122.523 2.149 . . . . 0.0 112.138 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 16' ' ' SER . 22.3 p . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 120.915 0.388 . . . . 0.0 109.997 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.422 HD13 ' O ' ' A' ' 8' ' ' ASP . 89.6 mt -82.5 132.05 35.21 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.2 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.69 -165.74 0.77 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 0.0 111.633 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.507 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 5.8 pt-20 -76.31 138.52 40.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.297 0.57 . . . . 0.0 111.14 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 63.31 39.48 9.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.964 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.405 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -109.82 138.74 45.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.011 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.422 ' O ' HD13 ' A' ' 3' ' ' LEU . 25.9 t70 -57.34 141.49 46.83 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.39 0.431 . . . . 0.0 110.488 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.0 p . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.55 0.69 . . . . 0.0 111.94 -179.207 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 2.3 m . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.2 m -76.29 144.68 40.12 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.353 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -63.93 148.72 48.85 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.4 ptmt -79.12 141.82 58.68 Favored Pre-proline 0 C--N 1.31 -1.118 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 88.0 Cg_endo -101.57 35.53 6.74 Favored 'Cis proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.995 -1.252 . . . . 0.0 113.599 0.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.848 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 25.6 m-85 -74.12 155.27 38.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -134.15 138.69 45.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.866 0.365 . . . . 0.0 111.689 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 49.9 t -68.85 120.81 15.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.576 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.3 p -102.05 124.72 48.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.279 0.561 . . . . 0.0 111.682 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 61.6 m -119.54 56.54 0.93 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.601 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.408 HG12 ' H ' ' A' ' 26' ' ' ILE . 17.2 pt -71.49 46.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 61.28 19.02 9.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.944 0.498 . . . . 0.0 112.08 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -120.9 131.92 54.66 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 50.0 t80 -91.63 129.03 44.09 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.127 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.512 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.6 Cg_endo -97.28 178.71 7.63 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.16 -1.183 . . . . 0.0 112.453 -0.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 75.4 m -78.86 151.06 32.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.3 p -149.77 134.75 17.91 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.979 -0.689 . . . . 0.0 112.247 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.2 m -67.66 130.59 43.5 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -122.3 151.42 59.11 Favored Pre-proline 0 C--N 1.32 -0.684 0 O-C-N 124.175 0.922 . . . . 0.0 110.076 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.848 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 38.4 Cg_exo . . . . . 0 N--CA 1.462 -0.364 0 C-N-CA 122.393 2.062 . . . . 0.0 110.48 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.8 p . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 80.2 mt -79.61 135.45 36.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.983 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.45 -166.82 0.92 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.174 0.511 . . . . 0.0 112.363 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.477 ' OE2' ' HB1' ' A' ' 4' ' ' ALA . 1.7 pm0 -73.78 132.36 42.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.058 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.73 38.37 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.544 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.85 141.46 36.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -64.93 148.85 50.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.111 0.481 . . . . 0.0 110.894 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.491 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.324 -0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 111.099 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.448 -0.528 0 CA-C-O 120.696 0.284 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 13.2 m -75.24 142.91 43.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.1 m -63.23 143.62 57.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.5 mtmt -78.14 144.45 67.22 Favored Pre-proline 0 C--N 1.313 -1.018 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.139 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.407 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 93.8 Cg_endo -101.19 40.09 4.31 Favored 'Cis proline' 0 N--CA 1.451 -0.989 0 C-N-CA 123.473 -1.47 . . . . 0.0 113.706 1.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.677 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 7.8 m-85 -77.48 145.03 37.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.894 0.378 . . . . 0.0 110.435 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.7 tp -120.23 137.54 54.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -71.27 120.77 17.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.883 179.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.4 p -103.88 129.04 51.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.05 0.452 . . . . 0.0 111.037 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.6 m -114.84 66.98 0.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.6 pt -70.28 47.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.91 22.06 12.24 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -129.71 133.26 46.95 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 20.2 t80 -92.38 128.6 44.11 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.171 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.4 Cg_endo -93.32 -177.89 8.18 Favored 'Cis proline' 0 N--CA 1.451 -1.016 0 C-N-CA 123.713 -1.369 . . . . 0.0 112.197 -0.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -78.55 171.56 14.94 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.7 p -152.95 128.93 10.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.6 m -69.3 127.13 31.95 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -117.63 149.65 45.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 124.038 0.836 . . . . 0.0 110.119 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.677 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.9 Cg_exo . . . . . 0 C--N 1.344 0.335 0 C-N-CA 122.898 2.399 . . . . 0.0 111.814 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.1 p . . . . . 0 N--CA 1.447 -0.603 0 CA-C-O 122.038 0.923 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.6 mt -79.61 130.1 35.07 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.62 -1.627 . . . . 0.0 111.065 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.36 -164.05 0.58 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.224 0.535 . . . . 0.0 112.203 -179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 8.3 pm0 -66.62 128.31 35.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.972 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.74 37.33 7.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.333 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -98.86 128.32 45.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -67.88 153.81 42.93 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.29 0.567 . . . . 0.0 111.902 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 4.0 p . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.634 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.636 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.8 m . . . . . 0 N--CA 1.452 -0.369 0 CA-C-O 120.733 0.302 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.4 m -73.37 146.83 44.88 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.19 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.411 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 63.3 m -63.02 140.59 58.89 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -77.99 141.78 63.67 Favored Pre-proline 0 C--N 1.312 -1.036 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.807 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -101.28 45.55 2.58 Favored 'Cis proline' 0 CA--C 1.538 0.712 0 C-N-CA 124.171 -1.179 . . . . 0.0 114.052 1.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 4.7 m-30 -79.47 148.46 31.88 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -128.29 134.79 49.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.131 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 2.5 t -75.19 116.56 16.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.462 0.648 . . . . 0.0 109.95 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.4 p -84.86 123.25 30.25 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.472 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.3 m -112.69 64.82 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.055 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.453 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.2 pt -70.93 47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 61.67 21.11 11.9 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.103 0.561 . . . . 0.0 112.417 178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -133.46 132.69 41.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.042 0.448 . . . . 0.0 109.892 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.535 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 12.6 t80 -91.83 133.62 30.4 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.895 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.535 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.91 174.14 15.44 Favored 'Cis proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.936 -1.277 . . . . 0.0 112.677 -0.318 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 57.3 m -79.1 164.24 24.45 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -147.46 124.61 11.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.96 -0.696 . . . . 0.0 112.678 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.3 m -65.48 124.59 22.7 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.832 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -111.01 149.31 40.26 Favored Pre-proline 0 C--N 1.318 -0.782 0 O-C-N 124.135 0.897 . . . . 0.0 108.849 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.592 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 27.5 Cg_endo . . . . . 0 N--CA 1.459 -0.558 0 C-N-CA 122.553 2.168 . . . . 0.0 110.408 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 81.2 mt -86.07 133.53 33.89 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.677 -178.674 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.533 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.53 -161.32 0.32 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.806 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.665 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -73.87 130.08 39.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.247 0.546 . . . . 0.0 111.395 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.26 38.9 7.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.736 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -101.17 137.32 39.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.959 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -61.32 142.95 56.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 1.8 p . . . . . 0 C--N 1.326 -0.416 0 CA-C-O 121.46 0.648 . . . . 0.0 111.503 -178.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 33.4 m -72.52 139.97 47.9 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.8 m -63.2 146.0 54.3 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.1 OUTLIER -78.58 139.74 59.11 Favored Pre-proline 0 C--N 1.311 -1.07 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.636 -179.064 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 86.8 Cg_endo -103.95 37.2 4.87 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.844 -1.315 . . . . 0.0 113.686 1.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.665 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 4.9 m-85 -66.73 156.56 35.04 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.397 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.4 tp -130.79 134.96 47.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.785 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.6 t -70.06 120.57 15.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.767 -0.652 . . . . 0.0 109.674 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.3 p -101.4 121.08 41.27 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.099 0.476 . . . . 0.0 111.666 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.3 m -112.12 62.57 0.62 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.0 tp -74.25 54.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 122.285 1.04 . . . . 0.0 112.445 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 55.95 23.46 6.67 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.373 -1.285 . . . . 0.0 112.897 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -128.77 133.62 48.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.019 0.438 . . . . 0.0 110.172 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.6 t80 -92.03 128.27 46.21 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.3 Cg_endo -95.69 179.61 8.22 Favored 'Cis proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.981 -1.258 . . . . 0.0 112.212 -0.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.82 162.04 26.37 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -147.67 129.87 15.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.431 -0.508 . . . . 0.0 112.263 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.5 m -69.0 127.53 33.47 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.555 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 36.4 mtt180 -116.85 160.19 37.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 123.768 0.667 . . . . 0.0 110.013 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.555 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 19.6 Cg_endo . . . . . 0 N--CA 1.462 -0.325 0 C-N-CA 122.284 1.99 . . . . 0.0 111.352 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.2 p . . . . . 0 N--CA 1.448 -0.542 0 CA-C-O 121.271 0.558 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 8' ' ' ASP . 90.5 mt -88.57 140.27 29.63 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.621 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.24 -177.07 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.052 0.453 . . . . 0.0 111.752 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.4 pt-20 -71.8 140.01 49.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.031 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 42.43 17.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.661 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.34 145.26 46.32 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.712 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.459 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.3 p30 -61.67 149.95 38.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.919 0.39 . . . . 0.0 110.947 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 C--N 1.327 -0.411 0 CA-C-O 121.787 0.803 . . . . 0.0 111.995 -179.081 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.607 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.6 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 14.6 m -65.13 144.04 57.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.544 0.211 . . . . 0.0 111.121 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.2 m -64.01 141.51 58.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -79.49 149.11 71.33 Favored Pre-proline 0 C--N 1.31 -1.117 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.936 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -96.71 34.4 8.89 Favored 'Cis proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.805 -1.748 . . . . 0.0 113.829 1.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.833 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 34.0 m-85 -77.94 145.17 36.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.872 0.367 . . . . 0.0 110.358 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -121.17 141.45 50.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.713 -178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.8 t -71.36 122.45 20.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.675 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -105.96 127.87 53.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 111.25 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.7 m -114.32 64.76 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 26' ' ' ILE . 9.9 tp -73.28 55.01 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.356 1.074 . . . . 0.0 112.484 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.11 23.67 7.15 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.366 -1.288 . . . . 0.0 112.992 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -127.91 132.95 49.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.991 0.424 . . . . 0.0 110.111 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 37.8 t80 -92.45 127.25 49.34 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.17 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.65 -177.7 7.81 Favored 'Cis proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.82 -1.325 . . . . 0.0 112.212 -0.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.15 165.18 24.27 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -149.51 131.97 15.7 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.487 -0.485 . . . . 0.0 112.037 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -70.18 132.37 45.68 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.506 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 30.1 mmt180 -126.74 160.63 57.71 Favored Pre-proline 0 C--N 1.322 -0.623 0 O-C-N 124.171 0.919 . . . . 0.0 109.016 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.833 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 18.8 Cg_endo . . . . . 0 C--N 1.343 0.279 0 C-N-CA 122.341 2.027 . . . . 0.0 111.17 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' N ' ' HD2' ' A' ' 1' ' ' LYS . 25.3 p -160.96 157.48 26.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.872 0.368 . . . . 0.0 110.5 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.452 ' HG ' ' HB3' ' A' ' 15' ' ' ASP . 86.4 mt -85.74 130.54 34.53 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.107 -179.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.423 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.92 -166.4 0.9 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.112 0.482 . . . . 0.0 112.269 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.3 pm0 -70.98 134.69 47.36 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.468 0.651 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.18 38.8 10.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.623 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.92 47.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.638 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.5 139.05 57.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.259 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p -138.92 148.15 43.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.95 0.881 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 13' ' ' SER . 57.8 m -148.98 145.53 19.74 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 114.123 -1.399 . . . . 0.0 109.066 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.0 -47.29 24.23 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 123.798 2.999 . . . . 0.0 113.338 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -108.75 -51.48 2.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.6 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.5 m -80.29 58.7 3.16 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.396 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.38 -135.61 1.89 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.235 -0.984 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.452 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 34.4 t0 -168.49 171.96 8.59 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.1 m -79.91 139.61 37.02 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 11.7 m -74.67 140.59 44.32 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 121.126 -0.23 . . . . 0.0 110.456 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.3 m -62.28 147.63 47.47 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -85.58 148.6 49.53 Favored Pre-proline 0 C--N 1.308 -1.213 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.22 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 96.2 Cg_endo -95.55 32.76 10.65 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.895 -1.71 . . . . 0.0 113.684 1.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.75 ' HD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -75.32 145.5 41.72 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 tp -128.38 140.51 51.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.798 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.2 t -68.29 122.55 18.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.3 p -101.66 124.34 47.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.153 0.501 . . . . 0.0 111.26 -179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.2 m -119.48 66.25 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.549 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.439 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.3 pt -70.85 45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 59.6 21.34 9.94 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.011 0.524 . . . . 0.0 111.932 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 23.8 m-85 -135.32 139.31 44.22 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 61.1 t80 -90.67 134.95 29.73 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.392 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 81.0 Cg_endo -98.92 168.74 10.29 Favored 'Cis proline' 0 N--CA 1.454 -0.851 0 C-N-CA 124.348 -1.105 . . . . 0.0 113.159 0.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.0 m -79.49 151.44 30.79 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.48 134.39 16.79 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.385 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 6.9 m -67.41 130.04 41.82 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -119.91 156.07 54.61 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 123.858 0.724 . . . . 0.0 109.844 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.75 ' HA ' ' HD2' ' A' ' 21' ' ' TYR . 19.8 Cg_endo -61.74 149.91 88.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.458 2.105 . . . . 0.0 110.477 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 25.0 tptt -78.48 144.89 35.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.397 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.14 -33.22 1.93 Allowed Glycine 0 N--CA 1.443 -0.845 0 N-CA-C 108.021 -2.031 . . . . 0.0 108.021 -177.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 . . . . . 0 C--O 1.241 0.616 0 CA-C-N 113.979 -1.111 . . . . 0.0 108.298 177.186 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.0 pttp . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -161.33 159.63 28.67 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 123.428 0.455 . . . . 0.0 109.911 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 84.9 mt -79.68 126.13 30.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.69 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.55 -159.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.315 0.579 . . . . 0.0 112.503 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.802 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -65.88 127.61 32.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.095 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.53 42.22 11.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.941 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.79 120.7 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.791 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 58.1 m-20 -58.47 125.88 25.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.02 141.07 28.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.581 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.43 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 6.0 m -79.26 128.38 75.88 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.029 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.47 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 49.9 Cg_endo -68.63 -51.46 0.51 Allowed 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.055 2.503 . . . . 0.0 114.191 -178.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.2 m-90 -79.64 -51.18 9.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.641 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -159.89 134.07 7.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.489 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.43 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -178.42 -146.91 6.72 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.49 158.07 15.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.114 0.483 . . . . 0.0 111.131 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 m -92.42 149.59 21.31 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.589 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.9 m -69.39 142.78 53.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.625 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -66.09 146.23 54.9 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.45 140.43 55.99 Favored Pre-proline 0 C--N 1.31 -1.113 0 C-N-CA 120.689 -0.405 . . . . 0.0 110.361 -179.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 91.2 Cg_endo -102.99 41.66 3.22 Favored 'Cis proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.399 -1.084 . . . . 0.0 113.553 1.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.802 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 1.7 m-85 -71.68 144.0 49.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -117.64 133.73 55.63 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.297 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.5 t -71.06 122.46 20.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.4 p -102.14 126.35 49.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.105 0.478 . . . . 0.0 111.726 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.0 m -114.3 64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.044 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.4 pt -71.21 45.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.67 20.93 10.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.071 0.548 . . . . 0.0 112.243 178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -128.81 135.38 49.06 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 31.6 t80 -91.52 129.98 40.94 Favored Pre-proline 0 C--N 1.316 -0.89 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.944 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 97.1 Cg_endo -97.18 178.51 7.81 Favored 'Cis proline' 0 N--CA 1.451 -1.013 0 C-N-CA 124.042 -1.232 . . . . 0.0 112.714 -0.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.1 m -79.62 149.89 31.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 1.4 p -138.96 135.63 34.56 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.49 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.0 m -67.0 127.08 31.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.503 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -112.56 146.0 34.1 Favored Pre-proline 0 C--N 1.321 -0.651 0 O-C-N 123.968 0.793 . . . . 0.0 109.936 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 20.5 Cg_exo -60.41 146.91 95.78 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.361 2.041 . . . . 0.0 110.248 178.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 31.1 tptt -79.37 140.47 37.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.362 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.23 31.38 0.12 Allowed Glycine 0 C--N 1.314 -0.646 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.836 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.26 1.647 0 CA-C-O 117.086 -1.435 . . . . 0.0 107.245 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.593 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 17.4 tptm . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 p -161.79 160.99 28.96 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 123.271 0.357 . . . . 0.0 110.171 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.4 mt -79.52 127.54 32.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.502 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.17 -161.07 0.28 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.253 0.549 . . . . 0.0 111.844 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.684 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 4.5 pt-20 -73.15 132.65 43.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.511 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.39 40.99 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.26 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.17 132.85 52.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.74 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.01 132.24 50.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.959 0.409 . . . . 0.0 110.794 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.7 m -89.94 153.47 20.59 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.361 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.0 m -78.62 129.17 75.0 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.123 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.47 -55.13 2.32 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.409 2.739 . . . . 0.0 113.906 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -91.19 -57.03 2.93 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.344 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.6 m -161.37 145.63 13.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.075 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.06 -144.39 7.79 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.124 -0.56 . . . . 0.0 111.754 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.593 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.5 OUTLIER -68.0 150.35 48.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.376 0.608 . . . . 0.0 111.448 179.555 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.1 m -103.1 146.85 27.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.757 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.552 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.6 m -66.18 137.8 57.25 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.7 m -62.92 156.86 23.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -97.26 150.18 36.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 C-N-CA 119.893 -0.723 . . . . 0.0 110.454 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.546 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 98.1 Cg_endo -93.92 35.26 7.87 Favored 'Cis proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.137 -1.61 . . . . 0.0 113.707 1.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 16.2 m-85 -68.47 154.93 40.9 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.856 0.36 . . . . 0.0 110.314 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -134.41 136.19 43.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.809 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -74.18 120.3 19.57 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -87.51 127.85 35.24 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.7 m -129.86 75.91 1.69 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.938 0.774 . . . . 0.0 109.145 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.7 pt -71.46 43.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 60.42 16.53 6.41 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.36 0.664 . . . . 0.0 112.081 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.399 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.743 ' CG ' ' HA ' ' A' ' 30' ' ' PRO . 6.7 t80 -80.44 151.77 72.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.743 ' HA ' ' CG ' ' A' ' 29' ' ' TYR . 10.8 Cg_endo -90.79 138.06 10.72 Favored 'Cis proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.599 -1.0 . . . . 0.0 114.192 1.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 67.9 m -79.25 139.29 37.93 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 177.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -145.01 140.03 27.88 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.213 -0.995 . . . . 0.0 113.099 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.3 129.18 39.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -117.23 151.03 47.31 Favored Pre-proline 0 C--N 1.323 -0.587 0 O-C-N 124.263 0.977 . . . . 0.0 109.662 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 16.5 Cg_exo -60.29 150.96 77.23 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.604 2.202 . . . . 0.0 110.907 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 36' ' ' LYS . 1.5 tppt? -78.54 126.37 30.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.964 0.888 . . . . 0.0 109.58 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.49 ' H ' ' HD3' ' A' ' 36' ' ' LYS . . . 141.78 -24.45 2.45 Favored Glycine 0 N--CA 1.442 -0.915 0 N-CA-C 105.779 -2.928 . . . . 0.0 105.779 -175.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 . . . . . 0 N--CA 1.443 -0.798 0 CA-C-N 112.492 -1.854 . . . . 0.0 107.216 176.911 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.2 tptm . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.1 p -161.59 158.81 26.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.742 0.306 . . . . 0.0 110.337 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.528 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 61.8 mt -79.7 133.64 36.37 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.83 -164.59 0.61 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.393 0.616 . . . . 0.0 112.004 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.635 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 56.4 tt0 -70.65 132.68 45.79 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.176 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.47 49.17 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.168 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.42 129.94 52.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.756 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.9 m-20 -54.79 126.99 26.4 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.241 0.543 . . . . 0.0 111.821 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 0.3 OUTLIER -102.96 148.37 25.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.319 179.732 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.29 126.29 81.68 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.983 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.415 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 37.3 Cg_endo -66.38 -57.02 0.24 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.992 2.461 . . . . 0.0 114.015 -178.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.415 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 23.9 m-90 -79.9 -54.14 6.1 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.3 m -159.32 139.54 12.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.583 0.23 . . . . 0.0 110.908 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.44 -152.18 21.01 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -70.43 142.74 51.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.129 0.49 . . . . 0.0 110.422 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 m -94.17 148.48 22.14 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.429 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.6 m -67.55 139.92 56.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.327 0.108 . . . . 0.0 110.964 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.2 m -65.16 138.99 58.62 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.43 149.41 72.01 Favored Pre-proline 0 C--N 1.31 -1.137 0 C-N-CA 120.286 -0.566 . . . . 0.0 110.454 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -96.44 37.74 6.04 Favored 'Cis proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.041 -1.65 . . . . 0.0 113.81 1.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 6.6 m-85 -74.55 146.53 42.55 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.108 0.48 . . . . 0.0 110.244 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.99 139.3 51.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.43 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 52.8 t -73.23 128.66 36.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.549 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.3 p -112.47 128.02 56.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.107 0.48 . . . . 0.0 111.481 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 86.6 m -111.87 67.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.424 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 18.0 pt -69.87 48.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.39 21.95 11.53 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.5 m-85 -132.91 133.26 43.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.1 t80 -91.92 130.32 38.9 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.008 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 37.7 Cg_endo -94.79 178.67 9.64 Favored 'Cis proline' 0 N--CA 1.448 -1.15 0 C-N-CA 123.927 -1.281 . . . . 0.0 112.566 -0.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 37.5 m -79.21 156.41 28.18 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.403 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -141.29 135.52 30.68 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.972 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -68.1 132.29 46.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.705 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -122.7 155.77 62.62 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.293 0.996 . . . . 0.0 108.997 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.635 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 18.9 Cg_endo -60.29 150.43 80.2 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.357 2.038 . . . . 0.0 110.388 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 17.6 tptt -78.56 140.51 38.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.397 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.2 -33.19 1.93 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 -177.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 . . . . . 0 C--O 1.242 0.687 0 CA-C-N 113.946 -1.127 . . . . 0.0 108.309 177.049 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.7 p -149.62 157.74 43.53 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.955 0.407 . . . . 0.0 110.287 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.562 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 55.9 mt -91.39 122.73 34.26 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.335 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.58 -160.25 0.25 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.278 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.666 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 3.9 pm0 -65.97 125.82 26.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.935 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.54 37.78 12.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -99.85 136.07 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -65.2 136.59 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.351 0.596 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.562 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 7.2 m -90.74 156.09 18.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.847 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.475 ' OG ' ' HA3' ' A' ' 14' ' ' GLY . 15.4 m -78.74 140.46 58.91 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.957 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.455 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 21.6 Cg_exo -65.09 -59.55 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.925 2.417 . . . . 0.0 113.668 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.455 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 17.5 m-90 -113.08 -34.94 5.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.692 -178.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m -155.69 141.08 17.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.61 0.243 . . . . 0.0 111.033 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' HA3' ' OG ' ' A' ' 10' ' ' SER . . . 167.14 -146.03 10.39 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.72 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -87.49 145.51 26.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.0 110.82 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 14.8 m -93.74 155.64 17.12 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.727 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 36.6 m -59.83 139.01 57.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.564 0.221 . . . . 0.0 111.104 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.434 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 58.3 m -65.68 148.62 51.45 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.2 OUTLIER -79.72 139.52 54.43 Favored Pre-proline 0 C--N 1.311 -1.079 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.179 179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 62.9 Cg_endo -106.74 46.56 1.9 Allowed 'Cis proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.167 -1.18 . . . . 0.0 113.579 1.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.666 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 3.4 m-85 -72.19 -165.0 0.16 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.196 -0.315 . . . . 0.0 110.884 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.3 tp -167.55 134.95 2.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.666 0.27 . . . . 0.0 110.889 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 35.6 t -72.96 128.64 36.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.696 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.2 p -111.19 127.78 55.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.066 0.46 . . . . 0.0 110.71 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.02 65.32 0.63 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.541 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 20.2 pt -70.29 47.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.189 -178.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 61.33 25.35 15.33 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.231 0.612 . . . . 0.0 112.649 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 16.3 m-85 -132.08 132.55 43.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 0.0 110.202 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 34.3 t80 -92.59 125.93 53.97 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.367 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.4 Cg_endo -93.41 179.6 10.3 Favored 'Cis proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.945 -1.273 . . . . 0.0 112.133 -0.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 23' ' ' CYS . 34.4 m -78.17 163.5 25.77 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 p -144.6 136.55 25.97 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.393 -0.523 . . . . 0.0 112.234 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.6 m -70.65 131.36 43.8 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.167 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -119.61 153.06 54.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.503 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 27.1 Cg_exo -57.93 153.93 41.53 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.251 1.968 . . . . 0.0 110.181 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 0.9 OUTLIER -77.38 120.5 22.47 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.927 -178.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.17 -27.45 2.41 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.559 -0.734 . . . . 0.0 109.174 178.359 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.459 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 7.5 mtmp? . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.4 p -151.61 153.62 34.84 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.048 0.452 . . . . 0.0 110.37 178.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -83.6 129.08 34.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.855 -178.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.539 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.83 -162.74 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.541 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.84 129.36 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.206 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.01 40.21 9.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.682 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.421 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.27 135.35 45.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.261 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 140.41 57.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.285 0.564 . . . . 0.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.0 m -101.54 149.05 24.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.276 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.7 m -79.11 130.45 69.47 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.95 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.47 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 32.9 Cg_endo -64.29 -53.83 1.01 Allowed 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 123.101 2.534 . . . . 0.0 114.162 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 22.0 m-90 -79.62 -50.21 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.628 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.3 p -171.12 141.0 1.59 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.796 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.93 -166.48 33.98 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.459 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 3.5 m-20 -68.95 142.15 54.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.922 0.391 . . . . 0.0 110.71 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.436 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.2 m -81.88 153.32 26.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.256 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 18.4 m -64.01 138.3 58.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.827 -0.169 . . . . 0.0 111.174 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.0 m -62.51 146.05 52.67 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -82.39 147.18 55.84 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.172 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.605 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.9 Cg_endo -98.0 36.79 6.66 Favored 'Cis proline' 0 N--CA 1.45 -1.087 0 C-N-CA 122.997 -1.668 . . . . 0.0 113.686 1.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.541 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 15.0 m-85 -77.8 147.28 35.33 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.032 0.444 . . . . 0.0 110.596 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -126.49 142.36 51.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.1 t -72.39 126.2 29.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.321 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -104.25 130.17 52.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.051 0.453 . . . . 0.0 110.958 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.5 m -114.51 65.79 0.67 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.39 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.862 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.49 43.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.749 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 62.81 22.29 13.31 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 123.103 0.561 . . . . 0.0 112.319 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -125.69 133.38 52.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -92.04 126.99 51.25 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.277 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -95.36 179.89 8.28 Favored 'Cis proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.961 -1.266 . . . . 0.0 112.257 -0.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 63.4 m -78.13 159.48 28.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -146.87 135.54 22.09 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.543 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.9 m -67.84 130.02 41.71 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.777 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -126.68 154.11 75.64 Favored Pre-proline 0 C--N 1.323 -0.579 0 O-C-N 124.456 1.098 . . . . 0.0 108.919 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.492 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 46.7 Cg_exo -54.05 150.03 32.97 Favored 'Trans proline' 0 N--CA 1.465 -0.171 0 C-N-CA 122.648 2.232 . . . . 0.0 111.576 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 13.4 ttpp -77.92 68.1 3.91 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.234 0.54 . . . . 0.0 110.047 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.78 -5.75 2.57 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 . . . . . 0 C--O 1.251 1.18 0 CA-C-O 117.723 -1.132 . . . . 0.0 110.542 -179.414 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.501 ' HG3' ' CG ' ' A' ' 15' ' ' ASP . 1.9 ptmm? . . . . . 0 N--CA 1.486 1.345 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.0 p -137.09 163.2 31.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.968 0.413 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 77.6 mt -102.11 127.32 49.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.484 -178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.25 -161.1 0.29 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.314 0.578 . . . . 0.0 112.456 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.585 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 10.3 pm0 -66.31 129.53 40.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.98 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.05 41.26 14.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.074 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.64 132.36 50.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.621 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.87 134.81 56.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.593 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -127.55 137.66 52.68 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.966 0.889 . . . . 0.0 112.206 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.445 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 19.6 m -88.52 141.23 30.24 Favored Pre-proline 0 C--N 1.315 -0.926 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.782 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.55 -37.36 90.43 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 123.264 2.642 . . . . 0.0 113.494 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -135.95 -60.77 0.72 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.92 0.39 . . . . 0.0 111.384 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -76.72 66.14 2.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.751 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -162.8 151.85 21.8 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.727 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.501 ' CG ' ' HG3' ' A' ' 1' ' ' LYS . 21.6 m-20 -60.22 148.68 35.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.962 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.7 m -79.03 147.46 32.84 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.4 m -64.52 140.62 58.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.529 0.204 . . . . 0.0 111.194 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.8 m -63.01 143.56 57.66 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -80.45 147.81 64.78 Favored Pre-proline 0 C--N 1.308 -1.229 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.803 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.759 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 93.7 Cg_endo -97.55 34.53 8.66 Favored 'Cis proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.893 -1.711 . . . . 0.0 114.017 1.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.597 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 22.0 m-85 -76.13 161.59 28.71 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.406 HD23 ' HH2' ' A' ' 38' ' ' TRP . 60.5 tp -141.8 140.46 33.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.2 t -67.59 132.5 47.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.857 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.3 p -119.5 128.66 54.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.298 0.57 . . . . 0.0 111.654 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 88.4 m -115.87 64.9 0.7 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.1 pt -69.81 48.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.39 20.74 9.05 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.032 0.533 . . . . 0.0 112.23 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.441 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -134.68 136.06 42.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.061 0.458 . . . . 0.0 110.019 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 43.4 t80 -90.79 134.42 30.54 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.488 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 60.9 Cg_endo -97.39 172.5 11.22 Favored 'Cis proline' 0 N--CA 1.453 -0.863 0 C-N-CA 124.236 -1.152 . . . . 0.0 113.106 0.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.5 m -79.08 146.21 33.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.3 137.36 21.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.109 -0.636 . . . . 0.0 112.272 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.3 m -66.5 129.94 41.53 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.637 ' HB2' ' CE3' ' A' ' 38' ' ' TRP . 21.5 mmt85 -119.7 160.68 41.34 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.597 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.8 Cg_endo -58.54 159.79 19.01 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.452 2.101 . . . . 0.0 111.569 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.759 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 51.9 tttp -77.97 77.76 4.47 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.692 0.758 . . . . 0.0 109.767 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.7 47.36 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.988 -178.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.637 ' CE3' ' HB2' ' A' ' 34' ' ' ARG . 3.4 p90 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.112 -0.947 . . . . 0.0 111.006 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -160.54 157.74 27.96 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.689 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.8 mt -79.24 134.62 36.65 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.904 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.465 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.39 -166.48 0.86 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.212 0.529 . . . . 0.0 112.403 -178.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.769 ' HB2' ' HG3' ' A' ' 35' ' ' PRO . 1.8 pm0 -73.09 129.64 38.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.13 37.08 14.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.608 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.94 140.14 36.63 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.632 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -62.9 148.73 46.45 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.138 0.494 . . . . 0.0 111.023 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -139.6 148.31 42.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.277 -179.601 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 9.4 m -79.68 130.59 67.11 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.06 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.463 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 48.2 Cg_endo -66.38 -48.35 2.49 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.299 2.666 . . . . 0.0 114.078 -178.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.463 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 15.7 m-90 -79.39 -51.99 8.67 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.5 m -160.95 137.05 8.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.134 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.19 -156.13 16.64 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.39 150.86 41.44 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.223 0.535 . . . . 0.0 110.657 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.1 m -85.7 145.73 27.15 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.403 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.476 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 9.1 m -73.89 140.51 45.73 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.1 m -61.71 143.11 56.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.9 ptpt -77.76 142.02 65.06 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.773 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 85.5 Cg_endo -101.46 41.34 3.62 Favored 'Cis proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.088 -1.213 . . . . 0.0 113.935 1.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.665 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 5.9 m-85 -78.25 147.65 34.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -127.17 136.94 52.78 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.7 t -67.52 124.85 24.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.993 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.5 p -110.18 126.81 54.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.101 0.477 . . . . 0.0 111.146 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 98.1 m -114.31 65.62 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.442 ' O ' HG12 ' A' ' 26' ' ' ILE . 16.3 tt -72.67 47.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.047 0.927 . . . . 0.0 112.358 -178.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 59.93 23.13 12.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.993 -1.003 . . . . 0.0 112.481 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -126.61 133.91 50.92 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 38.4 t80 -92.08 126.98 51.22 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.336 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.4 Cg_endo -95.49 -178.93 7.41 Favored 'Cis proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.363 -0.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.7 m -78.55 164.07 25.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.59 130.46 13.31 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.26 -0.576 . . . . 0.0 112.397 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.1 m -69.28 121.91 17.82 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 21.6 mmt180 -103.55 147.77 34.72 Favored Pre-proline 0 C--N 1.321 -0.656 0 O-C-N 123.926 0.766 . . . . 0.0 110.216 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.769 ' HG3' ' HB2' ' A' ' 5' ' ' GLU . 10.6 Cg_exo -63.32 147.28 93.79 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.53 2.153 . . . . 0.0 110.929 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HD3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -79.26 136.26 37.0 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 119.573 -0.851 . . . . 0.0 109.461 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.592 ' N ' ' HD3' ' A' ' 36' ' ' LYS . . . 142.01 -32.98 1.97 Allowed Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 106.847 -2.501 . . . . 0.0 106.847 -176.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.422 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 3.8 m-90 . . . . . 0 C--O 1.264 1.825 0 CA-C-N 113.26 -1.47 . . . . 0.0 107.567 176.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -160.7 160.86 31.97 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 123.507 0.504 . . . . 0.0 110.311 -179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -79.87 133.24 36.23 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.229 -179.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.507 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.21 -163.55 0.51 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.074 0.464 . . . . 0.0 112.212 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.592 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -72.64 131.53 42.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.327 0.584 . . . . 0.0 111.201 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.92 38.44 11.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.448 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.411 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.82 135.33 42.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.973 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 16.5 t70 -59.71 141.07 55.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.7 OUTLIER -139.42 138.47 36.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.951 0.882 . . . . 0.0 111.977 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.9 m -89.17 143.6 31.3 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.906 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.9 -37.29 77.36 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.623 2.882 . . . . 0.0 113.587 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 14.2 m-90 -133.73 -57.12 0.88 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.981 0.42 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.0 p -79.82 60.7 3.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.737 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -147.41 158.14 27.62 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.505 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.428 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 3.5 t0 -67.56 161.26 26.0 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.8 m -85.06 145.26 27.76 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.4 m -72.67 139.45 47.29 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.402 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 73.3 m -61.8 144.25 55.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.82 ' HD3' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.05 142.46 64.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.768 -178.762 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.486 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 90.6 Cg_endo -101.87 35.94 6.37 Favored 'Cis proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.298 -1.542 . . . . 0.0 113.677 0.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 10.0 m-85 -71.36 153.49 42.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.4 tp -133.03 138.91 46.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.603 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.6 t -68.5 122.48 18.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.646 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.5 p -101.99 126.07 48.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.116 0.484 . . . . 0.0 111.457 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 68.7 m -117.38 66.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.1 pt -70.37 46.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.74 21.37 10.15 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.012 0.525 . . . . 0.0 112.148 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.458 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 28.9 m-85 -136.27 138.21 41.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.073 0.463 . . . . 0.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 40.4 t80 -90.77 135.43 28.98 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.539 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.508 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.0 Cg_endo -97.97 170.53 11.22 Favored 'Cis proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.129 -1.196 . . . . 0.0 113.138 0.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.6 m -79.32 151.93 30.77 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.4 p -149.58 134.31 17.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.532 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.6 m -66.21 127.06 30.69 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.521 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 27.0 mmt180 -118.26 160.95 37.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 124.0 0.813 . . . . 0.0 109.25 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.7 Cg_endo -58.6 156.81 30.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.616 2.211 . . . . 0.0 111.676 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 47.8 tptt -77.74 115.36 17.43 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.88 47.24 2.12 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.416 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 4.7 p90 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.491 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.533 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 26.2 ttpp . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p -162.05 163.52 28.7 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.548 0.53 . . . . 0.0 109.893 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.4 mt -79.89 128.31 33.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.069 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.5 -162.3 0.4 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.201 0.524 . . . . 0.0 111.796 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.787 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -64.57 128.1 34.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.953 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.27 47.63 3.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.628 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.87 126.22 53.67 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.118 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.32 128.26 30.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 112.068 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -122.23 156.24 34.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.054 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.502 ' HB3' ' C ' ' A' ' 13' ' ' SER . 46.8 t -160.77 144.1 9.89 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.347 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -53.2 -33.13 63.3 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.65 2.9 . . . . 0.0 112.873 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -123.05 -48.9 1.98 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.944 0.402 . . . . 0.0 110.723 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.502 ' C ' ' HB3' ' A' ' 10' ' ' SER . 2.4 p -88.54 47.22 1.47 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.632 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -170.96 148.48 11.32 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.548 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.533 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 27.5 t0 -82.63 175.55 10.07 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -79.85 140.16 36.89 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.5 m -71.59 142.57 50.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.571 0.224 . . . . 0.0 110.78 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 94.0 m -68.22 143.84 55.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.769 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.83 144.23 59.59 Favored Pre-proline 0 C--N 1.312 -1.039 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.545 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 74.5 Cg_endo -103.18 38.94 4.34 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.785 -1.339 . . . . 0.0 113.688 1.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.787 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.9 m-85 -69.47 160.51 31.28 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.9 tp -125.04 134.79 52.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.872 0.368 . . . . 0.0 111.337 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 52.7 t -74.88 116.69 15.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.0 p -96.9 126.42 42.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.079 0.466 . . . . 0.0 111.457 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 83.3 m -117.63 66.59 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.118 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.1 tp -73.66 53.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 122.408 1.099 . . . . 0.0 112.408 -178.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.57 23.11 7.3 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.884 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.59 134.18 48.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.897 0.379 . . . . 0.0 110.153 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 t80 -92.26 128.55 44.56 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.936 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 72.6 Cg_endo -94.77 -179.29 8.18 Favored 'Cis proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.84 -1.317 . . . . 0.0 112.304 -0.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.1 m -79.25 171.82 14.66 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -153.42 129.96 10.69 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.261 -0.575 . . . . 0.0 111.855 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.31 127.5 33.17 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -120.0 147.2 43.91 Favored Pre-proline 0 C--N 1.319 -0.738 0 O-C-N 123.764 0.665 . . . . 0.0 109.302 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.521 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 34.6 Cg_exo -58.33 152.27 54.79 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.303 2.002 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HE2' ' HB2' ' A' ' 20' ' ' PRO . 21.0 ttmm -77.57 122.54 25.41 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.785 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.11 -30.7 2.23 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.481 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 6.1 m-90 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.584 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.6 156.63 25.98 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.868 0.366 . . . . 0.0 110.17 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -82.83 131.42 35.2 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.448 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.23 -161.97 0.36 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.523 ' OE2' ' HD3' ' A' ' 35' ' ' PRO . 16.7 tp10 -68.2 134.77 50.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.273 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.42 49.16 13.41 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.308 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.415 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -117.59 124.08 47.77 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.134 -0.626 . . . . 0.0 112.069 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.42 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 75.6 m-20 -54.59 126.17 22.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.246 0.545 . . . . 0.0 111.183 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -111.89 154.65 24.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.136 -178.896 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 27.7 t -137.09 136.77 21.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.749 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.2 -30.5 71.69 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 123.463 2.775 . . . . 0.0 113.607 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 14.0 m-90 -132.73 -48.34 0.88 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.3 t -83.25 52.24 2.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.504 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.45 147.26 7.52 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.824 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.49 160.53 24.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.902 0.382 . . . . 0.0 110.456 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -78.9 148.82 32.59 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 22.1 m -65.1 136.43 56.72 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.434 0.159 . . . . 0.0 111.309 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.9 m -61.4 141.67 57.48 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.642 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 25.9 mmmt -79.8 151.28 73.62 Favored Pre-proline 0 C--N 1.308 -1.204 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.248 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.642 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 88.6 Cg_endo -94.38 30.21 14.27 Favored 'Cis proline' 0 N--CA 1.452 -0.969 0 C-N-CA 122.808 -1.747 . . . . 0.0 114.022 1.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 27.8 m-85 -71.12 163.69 27.11 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.698 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 tp -139.85 142.3 36.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 43.8 t -69.61 129.09 38.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.727 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.6 p -114.51 127.93 56.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.145 0.497 . . . . 0.0 111.365 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 96.7 m -113.76 66.24 0.66 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.35 -0.841 . . . . 0.0 108.777 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.0 pt -69.84 47.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.04 22.79 11.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.514 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.1 m-85 -133.55 135.64 44.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.911 0.386 . . . . 0.0 109.98 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 36.0 t80 -91.53 130.22 40.08 Favored Pre-proline 0 C--N 1.315 -0.908 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.914 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 57.6 Cg_endo -96.92 178.05 8.25 Favored 'Cis proline' 0 N--CA 1.451 -1.008 0 C-N-CA 124.202 -1.166 . . . . 0.0 112.734 -0.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.5 m -79.48 151.51 30.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.42 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -144.3 138.4 27.88 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.734 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.3 m -67.58 133.66 49.82 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.63 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.0 mmt85 -130.72 169.07 14.55 Favored Pre-proline 0 C--O 1.236 0.387 0 O-C-N 125.193 1.558 . . . . 0.0 107.776 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.63 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 29.6 Cg_endo -63.09 157.96 46.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 121.931 1.754 . . . . 0.0 111.85 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 48.9 tttm -78.25 72.17 4.77 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.802 0.81 . . . . 0.0 109.829 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.61 46.66 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.917 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.577 ' CE3' ' HB2' ' A' ' 34' ' ' ARG . 4.8 p90 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.3 tptm . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -162.84 161.53 26.05 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.372 0.42 . . . . 0.0 110.361 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 89.2 mt -79.99 136.82 36.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.648 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.03 -163.22 0.46 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.329 0.585 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.608 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 36.1 tt0 -74.74 133.26 42.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.533 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.95 43.54 9.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.14 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.88 137.64 45.53 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.381 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.73 135.31 57.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.192 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -126.31 141.43 51.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.766 0.793 . . . . 0.0 112.485 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.458 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 46.9 t -160.24 137.51 6.87 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.018 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.7 Cg_exo -62.19 -49.34 6.43 Favored 'Trans proline' 0 N--CA 1.472 0.247 0 C-N-CA 122.941 2.428 . . . . 0.0 113.59 -178.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -102.08 10.71 39.29 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.671 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 10' ' ' SER . 28.8 m -156.03 51.77 0.55 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.117 0.484 . . . . 0.0 110.947 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.88 -133.02 1.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -166.26 -174.07 2.78 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -90.21 137.44 32.34 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 20.9 m -69.5 138.03 53.03 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.918 -0.128 . . . . 0.0 111.029 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.0 m -62.96 142.88 58.18 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -80.38 149.04 68.1 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.447 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 90.5 Cg_endo -96.36 37.64 6.1 Favored 'Cis proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.061 -1.641 . . . . 0.0 113.646 1.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.55 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 7.0 m-85 -77.13 148.91 35.75 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.169 0.509 . . . . 0.0 110.928 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 tp -126.76 140.73 52.16 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.292 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.9 t -69.65 121.92 18.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.867 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -96.76 122.64 39.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.3 m -121.22 59.22 0.95 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.593 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.1 pt -71.27 46.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 59.44 20.63 9.0 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.004 0.522 . . . . 0.0 111.996 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.17 136.01 50.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.063 0.459 . . . . 0.0 109.937 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.47 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 46.0 t80 -91.08 132.81 33.24 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.529 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.5 Cg_endo -99.05 172.05 9.24 Favored 'Cis proline' 0 N--CA 1.453 -0.859 0 C-N-CA 124.372 -1.095 . . . . 0.0 113.128 -0.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.4 m -79.25 149.08 31.97 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -150.92 134.52 16.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.769 -0.772 . . . . 0.0 112.622 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -64.58 127.95 33.71 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.0 mmt180 -120.01 159.47 46.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.432 1.082 . . . . 0.0 109.418 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 23.0 Cg_endo -62.43 152.68 75.68 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.376 2.051 . . . . 0.0 111.187 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 55.4 tttm -77.63 119.01 20.59 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.003 0.43 . . . . 0.0 110.125 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.61 -28.97 2.28 Favored Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.568 178.975 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.3 p -160.35 156.05 25.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.924 0.392 . . . . 0.0 110.327 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.563 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 78.5 mt -80.64 126.14 30.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.16 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.437 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -79.18 -164.99 0.69 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.038 0.446 . . . . 0.0 111.86 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.7 pm0 -68.42 129.85 41.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.303 0.573 . . . . 0.0 111.235 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.9 40.37 5.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.91 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -110.05 124.46 51.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.596 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -62.29 130.03 43.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.431 0.634 . . . . 0.0 111.543 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.563 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.8 m -81.2 154.3 26.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.79 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.7 m -79.05 128.2 77.04 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.915 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.481 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.6 Cg_endo -64.12 -53.86 1.05 Allowed 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 123.114 2.542 . . . . 0.0 113.738 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.481 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.8 m-90 -79.92 -51.78 8.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.69 0.281 . . . . 0.0 111.172 -179.088 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.8 t -176.97 148.49 0.64 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.576 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.26 -148.4 9.89 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.843 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.92 145.29 42.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.373 0.606 . . . . 0.0 111.149 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -90.06 155.89 18.76 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.642 178.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.6 m -65.63 139.54 58.43 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 121.33 -0.148 . . . . 0.0 110.77 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.449 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 57.6 m -65.38 146.65 54.63 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -79.55 140.43 55.61 Favored Pre-proline 0 C--N 1.31 -1.12 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -102.2 42.48 3.12 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.413 -1.078 . . . . 0.0 113.543 0.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.704 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -79.69 143.65 34.41 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.8 tp -120.66 139.36 53.13 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.921 0.391 . . . . 0.0 112.019 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.5 t -71.57 124.54 24.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.768 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -103.34 129.0 50.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.013 0.435 . . . . 0.0 111.294 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.4 m -115.88 65.91 0.7 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.256 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.867 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.76 43.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.574 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 61.91 21.75 12.52 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 122.978 0.511 . . . . 0.0 112.067 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -127.45 136.05 51.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.9 t80 -91.42 128.24 47.65 Favored Pre-proline 0 C--N 1.316 -0.853 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.087 179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 87.0 Cg_endo -97.71 178.26 7.54 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 124.134 -1.194 . . . . 0.0 112.708 -0.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 69.7 m -79.46 149.24 31.62 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -139.95 138.17 35.34 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.398 -0.521 . . . . 0.0 112.143 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.7 m -69.49 130.8 43.48 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -117.71 153.49 50.7 Favored Pre-proline 0 C--N 1.321 -0.667 0 O-C-N 123.799 0.687 . . . . 0.0 109.257 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.704 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.2 Cg_endo -63.18 154.58 66.73 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.335 2.023 . . . . 0.0 111.566 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -77.09 113.06 14.41 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.948 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.49 -27.53 2.36 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.643 178.895 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 23.9 p -160.96 159.7 29.85 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.212 0.32 . . . . 0.0 110.142 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 75.0 mt -80.68 126.31 31.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.699 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.528 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.34 -159.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.136 0.493 . . . . 0.0 112.104 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.649 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.8 128.12 34.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.269 0.557 . . . . 0.0 111.241 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.25 39.1 7.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.484 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.34 132.39 45.74 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.51 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 49.5 t0 -61.87 132.96 54.76 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.521 0.513 . . . . 0.0 110.671 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.0 m -92.98 153.65 18.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.169 0.509 . . . . 0.0 110.861 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.6 m -79.34 128.1 76.61 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.021 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 18.2 Cg_endo -60.87 -57.28 0.67 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.185 2.59 . . . . 0.0 113.832 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.446 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 16.0 m-90 -80.31 -52.55 7.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.081 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 t -176.93 147.9 0.61 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.245 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.86 -141.61 6.29 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.121 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -65.6 142.39 58.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.365 0.602 . . . . 0.0 111.365 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 m -97.62 150.93 20.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.527 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.536 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 35.1 m -64.69 140.79 58.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.408 0.147 . . . . 0.0 111.121 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -65.83 145.74 55.59 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.2 ptmt -78.79 140.23 58.54 Favored Pre-proline 0 C--N 1.309 -1.153 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.956 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.545 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 95.8 Cg_endo -102.29 38.13 5.01 Favored 'Cis proline' 0 N--CA 1.455 -0.773 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.403 0.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.649 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.2 m-85 -70.73 145.69 50.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 110.097 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 tp -123.82 139.68 53.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.036 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 40.2 t -70.47 125.62 27.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.069 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.5 p -100.15 128.64 46.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.021 0.438 . . . . 0.0 111.286 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 45.8 m -120.09 69.0 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.79 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 15.6 pt -70.57 46.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.73 21.23 10.0 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.147 0.579 . . . . 0.0 112.132 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 64.9 m-85 -144.41 140.3 28.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.221 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.672 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 30.0 t80 -90.45 142.62 28.34 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.672 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.4 Cg_endo -94.59 157.97 16.51 Favored 'Cis proline' 0 N--CA 1.455 -0.74 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.626 0.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.9 m -78.73 139.62 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.26 140.08 37.57 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.72 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.7 m -65.23 131.24 45.99 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.697 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.7 mmt85 -124.82 152.11 69.23 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.0 0.813 . . . . 0.0 109.435 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 45.9 Cg_exo -55.07 143.73 72.5 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.789 2.326 . . . . 0.0 112.114 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 26.8 tptp -78.93 66.09 4.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.564 0.697 . . . . 0.0 110.253 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.6 45.22 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.419 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 7.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.601 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? . . . . . 0 N--CA 1.483 1.187 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p -162.36 161.63 27.5 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.505 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.47 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 90.8 mt -79.41 136.62 37.01 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.437 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.53 -169.06 1.55 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -71.56 134.17 46.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.26 40.77 24.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.481 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.71 145.73 30.71 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.986 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.2 p30 -65.15 151.69 45.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.99 0.424 . . . . 0.0 110.594 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.47 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 7.6 p -158.03 -176.04 5.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.783 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.7 m -157.87 146.44 14.35 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.352 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -50.32 -37.17 49.67 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.84 3.027 . . . . 0.0 113.587 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.4 m-90 -128.61 -50.05 1.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.924 0.392 . . . . 0.0 110.914 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -79.67 56.83 2.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.33 155.26 26.5 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.183 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -74.13 168.19 20.06 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.9 m -79.44 141.29 36.93 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.606 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 29.9 m -74.74 142.43 44.36 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -63.0 145.93 54.32 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -77.82 141.78 64.44 Favored Pre-proline 0 C--N 1.312 -1.038 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.599 -178.867 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.576 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 89.1 Cg_endo -102.68 39.02 4.46 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.17 -1.179 . . . . 0.0 113.941 1.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 55.3 m-85 -77.13 146.06 37.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 0.0 110.744 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -119.71 137.43 53.93 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.495 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 53.5 t -71.83 115.33 10.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.701 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.5 p -95.99 127.13 41.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.058 0.456 . . . . 0.0 110.964 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 95.4 m -116.52 69.92 0.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.444 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.4 pt -69.07 48.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 61.39 22.45 12.84 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.444 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 63.0 m-85 -140.48 131.37 26.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.008 0.433 . . . . 0.0 110.235 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.553 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 5.9 t80 -92.09 136.54 25.83 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.822 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 96.3 Cg_endo -88.19 170.39 35.06 Favored 'Cis proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.667 -1.389 . . . . 0.0 112.625 -0.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.2 m -78.91 178.5 7.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.6 p -156.27 128.38 7.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.299 -0.56 . . . . 0.0 112.282 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.5 m -69.4 124.42 23.83 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 31.9 mmt180 -118.58 158.8 46.23 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.027 0.829 . . . . 0.0 109.714 -179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 19.4 Cg_endo -60.03 148.7 88.11 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.523 2.149 . . . . 0.0 112.138 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.576 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 27.5 ttpt -78.66 76.15 5.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.105 0.479 . . . . 0.0 110.216 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.35 40.43 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.141 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.517 ' HB2' ' HG2' ' A' ' 35' ' ' PRO . 53.3 t-105 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.475 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.8 ptpt . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 16' ' ' SER . 22.3 p -161.35 154.86 21.64 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 123.33 0.394 . . . . 0.0 109.997 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.422 HD13 ' O ' ' A' ' 8' ' ' ASP . 89.6 mt -82.5 132.05 35.21 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.2 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.69 -165.74 0.77 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 0.0 111.633 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.507 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 5.8 pt-20 -76.31 138.52 40.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.297 0.57 . . . . 0.0 111.14 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 63.31 39.48 9.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.964 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.405 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -109.82 138.74 45.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.011 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.422 ' O ' HD13 ' A' ' 3' ' ' LEU . 25.9 t70 -57.34 141.49 46.83 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.39 0.431 . . . . 0.0 110.488 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.0 p -156.27 -178.34 7.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.55 0.69 . . . . 0.0 111.94 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.1 m -154.82 145.9 16.5 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.094 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -50.71 -37.98 55.17 Favored 'Trans proline' 0 CA--C 1.53 0.324 0 C-N-CA 123.95 3.1 . . . . 0.0 113.86 -178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -129.97 -51.01 1.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.867 0.365 . . . . 0.0 111.196 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -78.44 58.39 2.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.742 -179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -170.81 154.06 22.09 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.589 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -63.13 157.11 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.051 0.453 . . . . 0.0 110.858 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 2.3 m -79.09 141.46 37.32 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.297 -0.41 . . . . 0.0 109.98 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.2 m -76.29 144.68 40.12 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.353 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -63.93 148.72 48.85 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.4 ptmt -79.12 141.82 58.68 Favored Pre-proline 0 C--N 1.31 -1.118 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 88.0 Cg_endo -101.57 35.53 6.74 Favored 'Cis proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.995 -1.252 . . . . 0.0 113.599 0.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.848 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 25.6 m-85 -74.12 155.27 38.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -134.15 138.69 45.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.866 0.365 . . . . 0.0 111.689 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 49.9 t -68.85 120.81 15.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.576 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.3 p -102.05 124.72 48.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.279 0.561 . . . . 0.0 111.682 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 61.6 m -119.54 56.54 0.93 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.601 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.408 HG12 ' H ' ' A' ' 26' ' ' ILE . 17.2 pt -71.49 46.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 61.28 19.02 9.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.944 0.498 . . . . 0.0 112.08 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -120.9 131.92 54.66 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 50.0 t80 -91.63 129.03 44.09 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.127 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.512 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.6 Cg_endo -97.28 178.71 7.63 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.16 -1.183 . . . . 0.0 112.453 -0.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 75.4 m -78.86 151.06 32.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.3 p -149.77 134.75 17.91 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.979 -0.689 . . . . 0.0 112.247 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.2 m -67.66 130.59 43.5 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -122.3 151.42 59.11 Favored Pre-proline 0 C--N 1.32 -0.684 0 O-C-N 124.175 0.922 . . . . 0.0 110.076 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.848 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 38.4 Cg_exo -57.65 146.46 84.77 Favored 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 122.393 2.062 . . . . 0.0 110.48 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 23.2 ttmt -77.73 124.96 28.62 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.947 -179.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -29.35 2.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.504 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 5.3 m-90 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.488 -0.767 . . . . 0.0 109.503 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.8 p -160.98 157.51 26.46 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 80.2 mt -79.61 135.45 36.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.983 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.45 -166.82 0.92 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.174 0.511 . . . . 0.0 112.363 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.477 ' OE2' ' HB1' ' A' ' 4' ' ' ALA . 1.7 pm0 -73.78 132.36 42.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.058 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.73 38.37 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.544 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.85 141.46 36.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -64.93 148.85 50.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.111 0.481 . . . . 0.0 110.894 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.491 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -142.53 149.32 38.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 111.099 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.7 m -79.82 131.21 64.54 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.081 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 52.4 Cg_endo -67.37 -47.27 2.28 Favored 'Trans proline' 0 N--CA 1.473 0.31 0 C-N-CA 123.386 2.724 . . . . 0.0 113.962 -178.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.499 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 15.9 m-90 -79.34 -51.58 9.23 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.591 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.2 m -161.42 135.09 6.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.024 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.67 -160.7 24.72 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -70.16 146.25 50.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.009 0.433 . . . . 0.0 110.775 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -81.88 145.53 30.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.287 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 13.2 m -75.24 142.91 43.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.1 m -63.23 143.62 57.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.5 mtmt -78.14 144.45 67.22 Favored Pre-proline 0 C--N 1.313 -1.018 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.139 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.585 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.8 Cg_endo -101.19 40.09 4.31 Favored 'Cis proline' 0 N--CA 1.451 -0.989 0 C-N-CA 123.473 -1.47 . . . . 0.0 113.706 1.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.677 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 7.8 m-85 -77.48 145.03 37.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.894 0.378 . . . . 0.0 110.435 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.7 tp -120.23 137.54 54.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -71.27 120.77 17.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.883 179.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.4 p -103.88 129.04 51.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.05 0.452 . . . . 0.0 111.037 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.6 m -114.84 66.98 0.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.6 pt -70.28 47.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.91 22.06 12.24 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -129.71 133.26 46.95 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 20.2 t80 -92.38 128.6 44.11 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.171 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.4 Cg_endo -93.32 -177.89 8.18 Favored 'Cis proline' 0 N--CA 1.451 -1.016 0 C-N-CA 123.713 -1.369 . . . . 0.0 112.197 -0.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -78.55 171.56 14.94 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.7 p -152.95 128.93 10.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.6 m -69.3 127.13 31.95 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -117.63 149.65 45.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 124.038 0.836 . . . . 0.0 110.119 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.677 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.9 Cg_exo -57.93 144.53 93.99 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.898 2.399 . . . . 0.0 111.814 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 43.1 tttm -78.86 68.97 4.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.541 0.686 . . . . 0.0 110.474 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.67 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.767 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.435 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 7.8 p90 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.462 -179.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.0 mttp . . . . . 0 N--CA 1.486 1.351 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.1 p -77.15 144.25 38.53 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 118.521 -1.272 . . . . 0.0 111.715 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.6 mt -79.61 130.1 35.07 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.62 -1.627 . . . . 0.0 111.065 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.36 -164.05 0.58 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.224 0.535 . . . . 0.0 112.203 -179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 8.3 pm0 -66.62 128.31 35.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.972 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.74 37.33 7.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.333 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -98.86 128.32 45.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -67.88 153.81 42.93 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.29 0.567 . . . . 0.0 111.902 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 4.0 p -151.55 -169.77 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.634 179.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 13' ' ' SER . 34.4 t -159.96 131.2 3.88 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.059 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 36.5 Cg_exo -64.4 -27.53 62.83 Favored 'Trans proline' 0 N--CA 1.471 0.151 0 C-N-CA 123.364 2.709 . . . . 0.0 112.309 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.449 ' CE3' ' HD2' ' A' ' 11' ' ' PRO . 30.2 m-90 -79.03 -24.05 43.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.521 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 10' ' ' SER . 9.8 t -176.99 125.57 0.15 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.482 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.18 150.23 6.49 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.867 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.89 161.86 25.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.908 0.385 . . . . 0.0 110.253 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.636 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.8 m -79.83 145.69 32.64 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.409 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.4 m -73.37 146.83 44.88 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.19 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.411 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 63.3 m -63.02 140.59 58.89 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -77.99 141.78 63.67 Favored Pre-proline 0 C--N 1.312 -1.036 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.807 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -101.28 45.55 2.58 Favored 'Cis proline' 0 CA--C 1.538 0.712 0 C-N-CA 124.171 -1.179 . . . . 0.0 114.052 1.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 4.7 m-30 -79.47 148.46 31.88 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -128.29 134.79 49.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.131 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 2.5 t -75.19 116.56 16.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.462 0.648 . . . . 0.0 109.95 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.4 p -84.86 123.25 30.25 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.472 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.3 m -112.69 64.82 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.055 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.453 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.2 pt -70.93 47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 61.67 21.11 11.9 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.103 0.561 . . . . 0.0 112.417 178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -133.46 132.69 41.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.042 0.448 . . . . 0.0 109.892 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.535 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 12.6 t80 -91.83 133.62 30.4 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.895 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.535 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.91 174.14 15.44 Favored 'Cis proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.936 -1.277 . . . . 0.0 112.677 -0.318 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 57.3 m -79.1 164.24 24.45 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -147.46 124.61 11.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.96 -0.696 . . . . 0.0 112.678 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.3 m -65.48 124.59 22.7 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.832 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -111.01 149.31 40.26 Favored Pre-proline 0 C--N 1.318 -0.782 0 O-C-N 124.135 0.897 . . . . 0.0 108.849 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.592 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 27.5 Cg_endo -64.56 150.38 88.32 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.553 2.168 . . . . 0.0 110.408 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.49 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 27.3 tptt -78.64 145.24 34.76 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.258 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.36 -33.59 1.89 Allowed Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 107.949 -2.06 . . . . 0.0 107.949 -177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 . . . . . 0 C--O 1.26 1.619 0 CA-C-O 117.734 -1.127 . . . . 0.0 108.229 177.043 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.4 tttm . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 p -160.88 165.89 29.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.983 0.42 . . . . 0.0 110.513 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 81.2 mt -86.07 133.53 33.89 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.677 -178.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.533 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.53 -161.32 0.32 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.806 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.665 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -73.87 130.08 39.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.247 0.546 . . . . 0.0 111.395 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.26 38.9 7.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.736 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -101.17 137.32 39.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.959 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -61.32 142.95 56.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 1.8 p -144.38 163.32 34.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.46 0.648 . . . . 0.0 111.503 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.437 ' HB3' ' C ' ' A' ' 13' ' ' SER . 35.4 t -152.6 142.49 14.94 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.858 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.19 -36.34 55.65 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.927 3.085 . . . . 0.0 113.5 -178.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -123.66 -49.65 1.88 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.043 0.449 . . . . 0.0 110.759 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.437 ' C ' ' HB3' ' A' ' 10' ' ' SER . 12.2 m -86.96 52.76 2.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.114 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.79 149.89 18.26 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.516 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.475 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 37.4 t0 -73.56 165.56 24.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -80.66 142.53 33.86 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 33.4 m -72.52 139.97 47.9 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.8 m -63.2 146.0 54.3 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.1 OUTLIER -78.58 139.74 59.11 Favored Pre-proline 0 C--N 1.311 -1.07 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.636 -179.064 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 86.8 Cg_endo -103.95 37.2 4.87 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.844 -1.315 . . . . 0.0 113.686 1.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.665 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 4.9 m-85 -66.73 156.56 35.04 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.397 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.4 tp -130.79 134.96 47.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.785 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.6 t -70.06 120.57 15.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.767 -0.652 . . . . 0.0 109.674 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.3 p -101.4 121.08 41.27 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.099 0.476 . . . . 0.0 111.666 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.3 m -112.12 62.57 0.62 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.0 tp -74.25 54.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 122.285 1.04 . . . . 0.0 112.445 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 55.95 23.46 6.67 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.373 -1.285 . . . . 0.0 112.897 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -128.77 133.62 48.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.019 0.438 . . . . 0.0 110.172 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.6 t80 -92.03 128.27 46.21 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.3 Cg_endo -95.69 179.61 8.22 Favored 'Cis proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.981 -1.258 . . . . 0.0 112.212 -0.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.82 162.04 26.37 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -147.67 129.87 15.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.431 -0.508 . . . . 0.0 112.263 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.5 m -69.0 127.53 33.47 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.555 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 36.4 mtt180 -116.85 160.19 37.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 123.768 0.667 . . . . 0.0 110.013 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.555 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 19.6 Cg_endo -62.95 150.55 88.2 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.284 1.99 . . . . 0.0 111.352 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.1 tptm -79.31 128.09 32.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.936 0.398 . . . . 0.0 110.481 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.21 50.21 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -178.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 m0 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.759 -179.465 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.9 pttm . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.2 p -134.01 153.42 51.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.271 0.558 . . . . 0.0 111.066 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 8' ' ' ASP . 90.5 mt -88.57 140.27 29.63 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.621 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.24 -177.07 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.052 0.453 . . . . 0.0 111.752 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.4 pt-20 -71.8 140.01 49.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.031 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 42.43 17.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.661 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.34 145.26 46.32 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.712 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.459 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.3 p30 -61.67 149.95 38.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.919 0.39 . . . . 0.0 110.947 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.37 153.08 39.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.787 0.803 . . . . 0.0 111.995 -179.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 31.6 t -108.41 138.72 20.28 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 114.532 -1.213 . . . . 0.0 108.884 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.55 -34.11 88.77 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.197 2.598 . . . . 0.0 113.384 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -140.15 -50.26 0.47 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.952 0.406 . . . . 0.0 111.473 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 m -78.04 58.57 2.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.873 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.96 156.53 22.78 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.441 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.5 149.77 28.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.607 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.6 m -79.02 145.85 33.65 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 14.6 m -65.13 144.04 57.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.544 0.211 . . . . 0.0 111.121 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.2 m -64.01 141.51 58.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -79.49 149.11 71.33 Favored Pre-proline 0 C--N 1.31 -1.117 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.936 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 97.5 Cg_endo -96.71 34.4 8.89 Favored 'Cis proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.805 -1.748 . . . . 0.0 113.829 1.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.833 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 34.0 m-85 -77.94 145.17 36.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.872 0.367 . . . . 0.0 110.358 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -121.17 141.45 50.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.713 -178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.8 t -71.36 122.45 20.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.675 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -105.96 127.87 53.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 111.25 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.7 m -114.32 64.76 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 26' ' ' ILE . 9.9 tp -73.28 55.01 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.356 1.074 . . . . 0.0 112.484 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.11 23.67 7.15 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.366 -1.288 . . . . 0.0 112.992 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -127.91 132.95 49.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.991 0.424 . . . . 0.0 110.111 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 37.8 t80 -92.45 127.25 49.34 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.17 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.65 -177.7 7.81 Favored 'Cis proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.82 -1.325 . . . . 0.0 112.212 -0.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.15 165.18 24.27 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -149.51 131.97 15.7 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.487 -0.485 . . . . 0.0 112.037 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -70.18 132.37 45.68 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.506 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 30.1 mmt180 -126.74 160.63 57.71 Favored Pre-proline 0 C--N 1.322 -0.623 0 O-C-N 124.171 0.919 . . . . 0.0 109.016 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.833 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 18.8 Cg_endo -59.24 153.55 52.32 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.341 2.027 . . . . 0.0 111.17 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 88.1 tttt -77.3 116.46 17.93 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.818 -179.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.79 45.74 1.88 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.128 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.461 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 5.5 p90 . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.129 -0.938 . . . . 0.0 110.382 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 16' ' ' SER . 25.3 p . . . . . 0 N--CA 1.449 -0.479 0 CA-C-O 120.872 0.368 . . . . 0.0 110.5 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.74 130.54 34.53 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.107 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.423 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.92 -166.4 0.9 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.112 0.482 . . . . 0.0 112.269 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.3 pm0 -70.98 134.69 47.36 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.468 0.651 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.18 38.8 10.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.623 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.92 47.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.638 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.5 139.05 57.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.259 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 C--N 1.326 -0.446 0 CA-C-O 121.95 0.881 . . . . 0.0 112.371 -179.869 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.1 m . . . . . 0 N--CA 1.445 -0.694 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 11.7 m -74.67 140.59 44.32 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 121.126 -0.23 . . . . 0.0 110.456 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.3 m -62.28 147.63 47.47 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -85.58 148.6 49.53 Favored Pre-proline 0 C--N 1.308 -1.213 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.22 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -95.55 32.76 10.65 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.895 -1.71 . . . . 0.0 113.684 1.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.75 ' HD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -75.32 145.5 41.72 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 tp -128.38 140.51 51.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.798 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.2 t -68.29 122.55 18.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.3 p -101.66 124.34 47.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.153 0.501 . . . . 0.0 111.26 -179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.2 m -119.48 66.25 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.549 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.439 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.3 pt -70.85 45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 59.6 21.34 9.94 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.011 0.524 . . . . 0.0 111.932 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.439 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 23.8 m-85 -135.32 139.31 44.22 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 61.1 t80 -90.67 134.95 29.73 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.392 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 81.0 Cg_endo -98.92 168.74 10.29 Favored 'Cis proline' 0 N--CA 1.454 -0.851 0 C-N-CA 124.348 -1.105 . . . . 0.0 113.159 0.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.0 m -79.49 151.44 30.79 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.48 134.39 16.79 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.385 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 6.9 m -67.41 130.04 41.82 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -119.91 156.07 54.61 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 123.858 0.724 . . . . 0.0 109.844 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.75 ' HA ' ' HD2' ' A' ' 21' ' ' TYR . 19.8 Cg_endo . . . . . 0 N--CA 1.462 -0.359 0 C-N-CA 122.458 2.105 . . . . 0.0 110.477 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 84.9 mt -79.68 126.13 30.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.69 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.55 -159.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.315 0.579 . . . . 0.0 112.503 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.802 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -65.88 127.61 32.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.095 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.53 42.22 11.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.941 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.79 120.7 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.791 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 58.1 m-20 -58.47 125.88 25.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.581 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 m . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.532 0.206 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.9 m -69.39 142.78 53.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.625 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -66.09 146.23 54.9 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.45 140.43 55.99 Favored Pre-proline 0 C--N 1.31 -1.113 0 C-N-CA 120.689 -0.405 . . . . 0.0 110.361 -179.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 91.2 Cg_endo -102.99 41.66 3.22 Favored 'Cis proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.399 -1.084 . . . . 0.0 113.553 1.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.802 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 1.7 m-85 -71.68 144.0 49.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -117.64 133.73 55.63 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.297 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.5 t -71.06 122.46 20.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.4 p -102.14 126.35 49.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.105 0.478 . . . . 0.0 111.726 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.0 m -114.3 64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.044 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.4 pt -71.21 45.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.67 20.93 10.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.071 0.548 . . . . 0.0 112.243 178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -128.81 135.38 49.06 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 31.6 t80 -91.52 129.98 40.94 Favored Pre-proline 0 C--N 1.316 -0.89 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.944 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 97.1 Cg_endo -97.18 178.51 7.81 Favored 'Cis proline' 0 N--CA 1.451 -1.013 0 C-N-CA 124.042 -1.232 . . . . 0.0 112.714 -0.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.1 m -79.62 149.89 31.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 1.4 p -138.96 135.63 34.56 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.49 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.0 m -67.0 127.08 31.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.503 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -112.56 146.0 34.1 Favored Pre-proline 0 C--N 1.321 -0.651 0 O-C-N 123.968 0.793 . . . . 0.0 109.936 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 20.5 Cg_exo . . . . . 0 N--CA 1.461 -0.438 0 C-N-CA 122.361 2.041 . . . . 0.0 110.248 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 p . . . . . 0 C--O 1.233 0.217 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.4 mt -79.52 127.54 32.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.502 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.17 -161.07 0.28 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.253 0.549 . . . . 0.0 111.844 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.684 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 4.5 pt-20 -73.15 132.65 43.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.511 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.39 40.99 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.26 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.17 132.85 52.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.74 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.01 132.24 50.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.959 0.409 . . . . 0.0 110.794 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.361 -179.883 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.552 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.6 m -66.18 137.8 57.25 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.7 m -62.92 156.86 23.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -97.26 150.18 36.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 C-N-CA 119.893 -0.723 . . . . 0.0 110.454 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.546 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 98.1 Cg_endo -93.92 35.26 7.87 Favored 'Cis proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.137 -1.61 . . . . 0.0 113.707 1.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 16.2 m-85 -68.47 154.93 40.9 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.856 0.36 . . . . 0.0 110.314 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -134.41 136.19 43.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.809 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -74.18 120.3 19.57 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -87.51 127.85 35.24 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.7 m -129.86 75.91 1.69 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.938 0.774 . . . . 0.0 109.145 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.7 pt -71.46 43.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 60.42 16.53 6.41 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.36 0.664 . . . . 0.0 112.081 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.399 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.743 ' CG ' ' HA ' ' A' ' 30' ' ' PRO . 6.7 t80 -80.44 151.77 72.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.743 ' HA ' ' CG ' ' A' ' 29' ' ' TYR . 10.8 Cg_endo -90.79 138.06 10.72 Favored 'Cis proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.599 -1.0 . . . . 0.0 114.192 1.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 67.9 m -79.25 139.29 37.93 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 177.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -145.01 140.03 27.88 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.213 -0.995 . . . . 0.0 113.099 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.3 129.18 39.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -117.23 151.03 47.31 Favored Pre-proline 0 C--N 1.323 -0.587 0 O-C-N 124.263 0.977 . . . . 0.0 109.662 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 16.5 Cg_exo . . . . . 0 C--N 1.345 0.348 0 C-N-CA 122.604 2.202 . . . . 0.0 110.907 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.1 p . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.528 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 61.8 mt -79.7 133.64 36.37 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.83 -164.59 0.61 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.393 0.616 . . . . 0.0 112.004 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.635 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 56.4 tt0 -70.65 132.68 45.79 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.176 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.47 49.17 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.168 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.42 129.94 52.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.756 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.9 m-20 -54.79 126.99 26.4 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.241 0.543 . . . . 0.0 111.821 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.319 179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.6 m -67.55 139.92 56.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.327 0.108 . . . . 0.0 110.964 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.2 m -65.16 138.99 58.62 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.43 149.41 72.01 Favored Pre-proline 0 C--N 1.31 -1.137 0 C-N-CA 120.286 -0.566 . . . . 0.0 110.454 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -96.44 37.74 6.04 Favored 'Cis proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.041 -1.65 . . . . 0.0 113.81 1.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 6.6 m-85 -74.55 146.53 42.55 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.108 0.48 . . . . 0.0 110.244 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.99 139.3 51.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.43 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 52.8 t -73.23 128.66 36.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.549 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.3 p -112.47 128.02 56.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.107 0.48 . . . . 0.0 111.481 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 86.6 m -111.87 67.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.424 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 18.0 pt -69.87 48.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.39 21.95 11.53 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.5 m-85 -132.91 133.26 43.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.1 t80 -91.92 130.32 38.9 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.008 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 37.7 Cg_endo -94.79 178.67 9.64 Favored 'Cis proline' 0 N--CA 1.448 -1.15 0 C-N-CA 123.927 -1.281 . . . . 0.0 112.566 -0.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 37.5 m -79.21 156.41 28.18 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.403 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -141.29 135.52 30.68 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.972 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -68.1 132.29 46.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.705 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -122.7 155.77 62.62 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.293 0.996 . . . . 0.0 108.997 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.635 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 18.9 Cg_endo . . . . . 0 N--CA 1.463 -0.308 0 C-N-CA 122.357 2.038 . . . . 0.0 110.388 178.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.7 p . . . . . 0 N--CA 1.446 -0.661 0 CA-C-O 120.955 0.407 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.562 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 55.9 mt -91.39 122.73 34.26 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.335 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.58 -160.25 0.25 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.278 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.666 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 3.9 pm0 -65.97 125.82 26.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.935 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.54 37.78 12.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -99.85 136.07 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -65.2 136.59 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.351 0.596 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.562 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 7.2 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.847 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 14.8 m . . . . . 0 N--CA 1.455 -0.219 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 36.6 m -59.83 139.01 57.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.564 0.221 . . . . 0.0 111.104 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.434 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 58.3 m -65.68 148.62 51.45 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.2 OUTLIER -79.72 139.52 54.43 Favored Pre-proline 0 C--N 1.311 -1.079 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.179 179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 62.9 Cg_endo -106.74 46.56 1.9 Allowed 'Cis proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.167 -1.18 . . . . 0.0 113.579 1.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.666 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 3.4 m-85 -72.19 -165.0 0.16 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.196 -0.315 . . . . 0.0 110.884 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.3 tp -167.55 134.95 2.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.666 0.27 . . . . 0.0 110.889 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 35.6 t -72.96 128.64 36.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.696 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.2 p -111.19 127.78 55.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.066 0.46 . . . . 0.0 110.71 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.02 65.32 0.63 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.541 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 20.2 pt -70.29 47.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.189 -178.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 61.33 25.35 15.33 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.231 0.612 . . . . 0.0 112.649 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 16.3 m-85 -132.08 132.55 43.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 0.0 110.202 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 34.3 t80 -92.59 125.93 53.97 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.367 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.4 Cg_endo -93.41 179.6 10.3 Favored 'Cis proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.945 -1.273 . . . . 0.0 112.133 -0.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 23' ' ' CYS . 34.4 m -78.17 163.5 25.77 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 p -144.6 136.55 25.97 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.393 -0.523 . . . . 0.0 112.234 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.6 m -70.65 131.36 43.8 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.167 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -119.61 153.06 54.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.503 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 27.1 Cg_exo . . . . . 0 N--CA 1.461 -0.42 0 C-N-CA 122.251 1.968 . . . . 0.0 110.181 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.4 p . . . . . 0 N--CA 1.445 -0.693 0 CA-C-O 121.048 0.452 . . . . 0.0 110.37 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -83.6 129.08 34.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.855 -178.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.539 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.83 -162.74 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.541 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.84 129.36 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.206 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.01 40.21 9.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.682 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.421 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.27 135.35 45.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.261 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 140.41 57.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.285 0.564 . . . . 0.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.276 -179.38 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.436 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.2 m . . . . . 0 N--CA 1.452 -0.368 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 18.4 m -64.01 138.3 58.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.827 -0.169 . . . . 0.0 111.174 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.0 m -62.51 146.05 52.67 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -82.39 147.18 55.84 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.172 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -98.0 36.79 6.66 Favored 'Cis proline' 0 N--CA 1.45 -1.087 0 C-N-CA 122.997 -1.668 . . . . 0.0 113.686 1.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.541 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 15.0 m-85 -77.8 147.28 35.33 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.032 0.444 . . . . 0.0 110.596 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -126.49 142.36 51.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.1 t -72.39 126.2 29.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.321 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -104.25 130.17 52.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.051 0.453 . . . . 0.0 110.958 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.5 m -114.51 65.79 0.67 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.39 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.862 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.49 43.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 62.81 22.29 13.31 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 123.103 0.561 . . . . 0.0 112.319 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -125.69 133.38 52.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -92.04 126.99 51.25 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.277 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -95.36 179.89 8.28 Favored 'Cis proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.961 -1.266 . . . . 0.0 112.257 -0.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 63.4 m -78.13 159.48 28.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -146.87 135.54 22.09 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.543 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.9 m -67.84 130.02 41.71 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.777 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -126.68 154.11 75.64 Favored Pre-proline 0 C--N 1.323 -0.579 0 O-C-N 124.456 1.098 . . . . 0.0 108.919 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.492 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 46.7 Cg_exo . . . . . 0 N--CA 1.465 -0.171 0 C-N-CA 122.648 2.232 . . . . 0.0 111.576 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.0 p . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.968 0.413 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 77.6 mt -102.11 127.32 49.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.484 -178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.25 -161.1 0.29 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.314 0.578 . . . . 0.0 112.456 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.585 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 10.3 pm0 -66.31 129.53 40.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.98 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.05 41.26 14.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.074 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.64 132.36 50.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.621 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.87 134.81 56.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.593 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.512 -0.486 0 CA-C-O 121.966 0.889 . . . . 0.0 112.206 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.7 m . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.4 m -64.52 140.62 58.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.529 0.204 . . . . 0.0 111.194 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.8 m -63.01 143.56 57.66 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -80.45 147.81 64.78 Favored Pre-proline 0 C--N 1.308 -1.229 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.803 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -97.55 34.53 8.66 Favored 'Cis proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.893 -1.711 . . . . 0.0 114.017 1.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.597 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 22.0 m-85 -76.13 161.59 28.71 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -141.8 140.46 33.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.2 t -67.59 132.5 47.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.857 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.3 p -119.5 128.66 54.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.298 0.57 . . . . 0.0 111.654 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 88.4 m -115.87 64.9 0.7 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.1 pt -69.81 48.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.39 20.74 9.05 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.032 0.533 . . . . 0.0 112.23 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.441 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -134.68 136.06 42.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.061 0.458 . . . . 0.0 110.019 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 43.4 t80 -90.79 134.42 30.54 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.488 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 60.9 Cg_endo -97.39 172.5 11.22 Favored 'Cis proline' 0 N--CA 1.453 -0.863 0 C-N-CA 124.236 -1.152 . . . . 0.0 113.106 0.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.5 m -79.08 146.21 33.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.3 137.36 21.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.109 -0.636 . . . . 0.0 112.272 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.3 m -66.5 129.94 41.53 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.523 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 21.5 mmt85 -119.7 160.68 41.34 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.597 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.8 Cg_endo . . . . . 0 C--N 1.345 0.347 0 C-N-CA 122.452 2.101 . . . . 0.0 111.569 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.8 mt -79.24 134.62 36.65 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.904 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.465 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.39 -166.48 0.86 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.212 0.529 . . . . 0.0 112.403 -178.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.769 ' HB2' ' HG3' ' A' ' 35' ' ' PRO . 1.8 pm0 -73.09 129.64 38.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.13 37.08 14.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.608 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.94 140.14 36.63 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.632 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -62.9 148.73 46.45 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.138 0.494 . . . . 0.0 111.023 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.277 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.476 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 9.1 m -73.89 140.51 45.73 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.1 m -61.71 143.11 56.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.9 ptpt -77.76 142.02 65.06 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.773 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 85.5 Cg_endo -101.46 41.34 3.62 Favored 'Cis proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.088 -1.213 . . . . 0.0 113.935 1.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.665 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 5.9 m-85 -78.25 147.65 34.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -127.17 136.94 52.78 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.7 t -67.52 124.85 24.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.993 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.5 p -110.18 126.81 54.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.101 0.477 . . . . 0.0 111.146 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 98.1 m -114.31 65.62 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.442 ' O ' HG12 ' A' ' 26' ' ' ILE . 16.3 tt -72.67 47.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.047 0.927 . . . . 0.0 112.358 -178.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 59.93 23.13 12.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.993 -1.003 . . . . 0.0 112.481 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -126.61 133.91 50.92 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 38.4 t80 -92.08 126.98 51.22 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.336 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.4 Cg_endo -95.49 -178.93 7.41 Favored 'Cis proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.363 -0.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.7 m -78.55 164.07 25.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.59 130.46 13.31 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.26 -0.576 . . . . 0.0 112.397 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.1 m -69.28 121.91 17.82 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 21.6 mmt180 -103.55 147.77 34.72 Favored Pre-proline 0 C--N 1.321 -0.656 0 O-C-N 123.926 0.766 . . . . 0.0 110.216 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.769 ' HG3' ' HB2' ' A' ' 5' ' ' GLU . 10.6 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 122.53 2.153 . . . . 0.0 110.929 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.792 0.329 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -79.87 133.24 36.23 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.229 -179.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.507 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.21 -163.55 0.51 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.074 0.464 . . . . 0.0 112.212 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.592 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -72.64 131.53 42.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.327 0.584 . . . . 0.0 111.201 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.92 38.44 11.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.448 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.411 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.82 135.33 42.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.973 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 16.5 t70 -59.71 141.07 55.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 121.951 0.882 . . . . 0.0 111.977 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.448 -0.571 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.4 m -72.67 139.45 47.29 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.402 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 73.3 m -61.8 144.25 55.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.82 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.05 142.46 64.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.768 -178.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 90.6 Cg_endo -101.87 35.94 6.37 Favored 'Cis proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.298 -1.542 . . . . 0.0 113.677 0.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 10.0 m-85 -71.36 153.49 42.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.4 tp -133.03 138.91 46.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.603 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.6 t -68.5 122.48 18.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.646 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.5 p -101.99 126.07 48.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.116 0.484 . . . . 0.0 111.457 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 68.7 m -117.38 66.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.1 pt -70.37 46.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.74 21.37 10.15 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.012 0.525 . . . . 0.0 112.148 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.458 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 28.9 m-85 -136.27 138.21 41.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.073 0.463 . . . . 0.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 40.4 t80 -90.77 135.43 28.98 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.539 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.508 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.0 Cg_endo -97.97 170.53 11.22 Favored 'Cis proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.129 -1.196 . . . . 0.0 113.138 0.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.6 m -79.32 151.93 30.77 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.4 p -149.58 134.31 17.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.532 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.6 m -66.21 127.06 30.69 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.521 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 27.0 mmt180 -118.26 160.95 37.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 124.0 0.813 . . . . 0.0 109.25 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.7 Cg_endo . . . . . 0 C--N 1.345 0.357 0 C-N-CA 122.616 2.211 . . . . 0.0 111.676 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.4 mt -79.89 128.31 33.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.069 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.5 -162.3 0.4 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.201 0.524 . . . . 0.0 111.796 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.787 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -64.57 128.1 34.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.953 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.27 47.63 3.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.628 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.87 126.22 53.67 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.118 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.32 128.26 30.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 112.068 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.054 179.764 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.449 -0.49 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.5 m -71.59 142.57 50.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.571 0.224 . . . . 0.0 110.78 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 94.0 m -68.22 143.84 55.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.769 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.83 144.23 59.59 Favored Pre-proline 0 C--N 1.312 -1.039 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.445 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 74.5 Cg_endo -103.18 38.94 4.34 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.785 -1.339 . . . . 0.0 113.688 1.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.787 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.9 m-85 -69.47 160.51 31.28 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.9 tp -125.04 134.79 52.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.872 0.368 . . . . 0.0 111.337 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 52.7 t -74.88 116.69 15.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.0 p -96.9 126.42 42.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.079 0.466 . . . . 0.0 111.457 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 83.3 m -117.63 66.59 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.118 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.1 tp -73.66 53.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 122.408 1.099 . . . . 0.0 112.408 -178.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.57 23.11 7.3 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.884 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.59 134.18 48.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.897 0.379 . . . . 0.0 110.153 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 t80 -92.26 128.55 44.56 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.936 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 72.6 Cg_endo -94.77 -179.29 8.18 Favored 'Cis proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.84 -1.317 . . . . 0.0 112.304 -0.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.1 m -79.25 171.82 14.66 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -153.42 129.96 10.69 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.261 -0.575 . . . . 0.0 111.855 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.31 127.5 33.17 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -120.0 147.2 43.91 Favored Pre-proline 0 C--N 1.319 -0.738 0 O-C-N 123.764 0.665 . . . . 0.0 109.302 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.521 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 34.6 Cg_exo . . . . . 0 N--CA 1.461 -0.386 0 C-N-CA 122.303 2.002 . . . . 0.0 110.695 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 120.868 0.366 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -82.83 131.42 35.2 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.448 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.23 -161.97 0.36 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.523 ' OE2' ' HD3' ' A' ' 35' ' ' PRO . 16.7 tp10 -68.2 134.77 50.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.273 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.42 49.16 13.41 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.308 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.415 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -117.59 124.08 47.77 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.134 -0.626 . . . . 0.0 112.069 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.42 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 75.6 m-20 -54.59 126.17 22.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.246 0.545 . . . . 0.0 111.183 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 3' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.136 -178.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 22.1 m -65.1 136.43 56.72 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.434 0.159 . . . . 0.0 111.309 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.9 m -61.4 141.67 57.48 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.642 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 25.9 mmmt -79.8 151.28 73.62 Favored Pre-proline 0 C--N 1.308 -1.204 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.248 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.642 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 88.6 Cg_endo -94.38 30.21 14.27 Favored 'Cis proline' 0 N--CA 1.452 -0.969 0 C-N-CA 122.808 -1.747 . . . . 0.0 114.022 1.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 27.8 m-85 -71.12 163.69 27.11 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.698 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 tp -139.85 142.3 36.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 43.8 t -69.61 129.09 38.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.727 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.6 p -114.51 127.93 56.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.145 0.497 . . . . 0.0 111.365 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 96.7 m -113.76 66.24 0.66 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.35 -0.841 . . . . 0.0 108.777 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.0 pt -69.84 47.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.04 22.79 11.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.514 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.1 m-85 -133.55 135.64 44.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.911 0.386 . . . . 0.0 109.98 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 36.0 t80 -91.53 130.22 40.08 Favored Pre-proline 0 C--N 1.315 -0.908 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.914 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 57.6 Cg_endo -96.92 178.05 8.25 Favored 'Cis proline' 0 N--CA 1.451 -1.008 0 C-N-CA 124.202 -1.166 . . . . 0.0 112.734 -0.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.5 m -79.48 151.51 30.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.42 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -144.3 138.4 27.88 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.734 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.3 m -67.58 133.66 49.82 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.63 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.0 mmt85 -130.72 169.07 14.55 Favored Pre-proline 0 C--O 1.236 0.387 0 O-C-N 125.193 1.558 . . . . 0.0 107.776 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.63 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 29.6 Cg_endo . . . . . 0 C--N 1.349 0.6 0 C-N-CA 121.931 1.754 . . . . 0.0 111.85 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.648 0.261 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 89.2 mt -79.99 136.82 36.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.648 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.03 -163.22 0.46 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.329 0.585 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.608 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 36.1 tt0 -74.74 133.26 42.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.533 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.95 43.54 9.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.14 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.88 137.64 45.53 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.381 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.73 135.31 57.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.192 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 CA-C-O 121.766 0.793 . . . . 0.0 112.485 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.219 -0.545 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 20.9 m -69.5 138.03 53.03 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.918 -0.128 . . . . 0.0 111.029 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.0 m -62.96 142.88 58.18 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -80.38 149.04 68.1 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.447 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -96.36 37.64 6.1 Favored 'Cis proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.061 -1.641 . . . . 0.0 113.646 1.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.55 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 7.0 m-85 -77.13 148.91 35.75 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.169 0.509 . . . . 0.0 110.928 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 tp -126.76 140.73 52.16 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.292 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.9 t -69.65 121.92 18.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.867 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -96.76 122.64 39.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.3 m -121.22 59.22 0.95 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.593 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.1 pt -71.27 46.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 59.44 20.63 9.0 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.004 0.522 . . . . 0.0 111.996 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.17 136.01 50.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.063 0.459 . . . . 0.0 109.937 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.47 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 46.0 t80 -91.08 132.81 33.24 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.529 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.5 Cg_endo -99.05 172.05 9.24 Favored 'Cis proline' 0 N--CA 1.453 -0.859 0 C-N-CA 124.372 -1.095 . . . . 0.0 113.128 -0.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.4 m -79.25 149.08 31.97 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -150.92 134.52 16.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.769 -0.772 . . . . 0.0 112.622 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -64.58 127.95 33.71 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.0 mmt180 -120.01 159.47 46.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.432 1.082 . . . . 0.0 109.418 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 23.0 Cg_endo . . . . . 0 N--CA 1.461 -0.401 0 C-N-CA 122.376 2.051 . . . . 0.0 111.187 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.563 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 78.5 mt -80.64 126.14 30.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.16 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.437 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -79.18 -164.99 0.69 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.038 0.446 . . . . 0.0 111.86 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.7 pm0 -68.42 129.85 41.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.303 0.573 . . . . 0.0 111.235 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.9 40.37 5.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.91 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -110.05 124.46 51.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.596 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -62.29 130.03 43.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.431 0.634 . . . . 0.0 111.543 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.563 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.8 m . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.79 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.6 m -65.63 139.54 58.43 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 121.33 -0.148 . . . . 0.0 110.77 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.449 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 57.6 m -65.38 146.65 54.63 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -79.55 140.43 55.61 Favored Pre-proline 0 C--N 1.31 -1.12 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -102.2 42.48 3.12 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.413 -1.078 . . . . 0.0 113.543 0.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.704 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -79.69 143.65 34.41 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.8 tp -120.66 139.36 53.13 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.921 0.391 . . . . 0.0 112.019 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.5 t -71.57 124.54 24.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.768 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -103.34 129.0 50.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.013 0.435 . . . . 0.0 111.294 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.4 m -115.88 65.91 0.7 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.256 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.867 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.76 43.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.574 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 61.91 21.75 12.52 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 122.978 0.511 . . . . 0.0 112.067 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -127.45 136.05 51.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.9 t80 -91.42 128.24 47.65 Favored Pre-proline 0 C--N 1.316 -0.853 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.087 179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 87.0 Cg_endo -97.71 178.26 7.54 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 124.134 -1.194 . . . . 0.0 112.708 -0.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 69.7 m -79.46 149.24 31.62 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -139.95 138.17 35.34 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.398 -0.521 . . . . 0.0 112.143 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.7 m -69.49 130.8 43.48 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -117.71 153.49 50.7 Favored Pre-proline 0 C--N 1.321 -0.667 0 O-C-N 123.799 0.687 . . . . 0.0 109.257 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.704 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.2 Cg_endo . . . . . 0 N--CA 1.459 -0.542 0 C-N-CA 122.335 2.023 . . . . 0.0 111.566 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 23.9 p . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 75.0 mt -80.68 126.31 31.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.699 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.528 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.34 -159.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.136 0.493 . . . . 0.0 112.104 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.649 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.8 128.12 34.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.269 0.557 . . . . 0.0 111.241 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.25 39.1 7.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.484 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.34 132.39 45.74 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.51 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 49.5 t0 -61.87 132.96 54.76 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.521 0.513 . . . . 0.0 110.671 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 C--N 1.324 -0.519 0 CA-C-O 121.169 0.509 . . . . 0.0 110.861 -179.782 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 m . . . . . 0 N--CA 1.449 -0.476 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.536 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 35.1 m -64.69 140.79 58.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.408 0.147 . . . . 0.0 111.121 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -65.83 145.74 55.59 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.2 ptmt -78.79 140.23 58.54 Favored Pre-proline 0 C--N 1.309 -1.153 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.956 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.429 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 95.8 Cg_endo -102.29 38.13 5.01 Favored 'Cis proline' 0 N--CA 1.455 -0.773 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.403 0.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.649 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.2 m-85 -70.73 145.69 50.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 110.097 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 tp -123.82 139.68 53.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.036 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 40.2 t -70.47 125.62 27.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.069 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.5 p -100.15 128.64 46.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.021 0.438 . . . . 0.0 111.286 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 45.8 m -120.09 69.0 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.79 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 15.6 pt -70.57 46.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.73 21.23 10.0 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.147 0.579 . . . . 0.0 112.132 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 64.9 m-85 -144.41 140.3 28.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.221 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.672 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 30.0 t80 -90.45 142.62 28.34 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.672 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.4 Cg_endo -94.59 157.97 16.51 Favored 'Cis proline' 0 N--CA 1.455 -0.74 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.626 0.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.9 m -78.73 139.62 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.26 140.08 37.57 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.72 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.7 m -65.23 131.24 45.99 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.697 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.7 mmt85 -124.82 152.11 69.23 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.0 0.813 . . . . 0.0 109.435 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 45.9 Cg_exo . . . . . 0 C--N 1.344 0.311 0 C-N-CA 122.789 2.326 . . . . 0.0 112.114 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.47 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 90.8 mt -79.41 136.62 37.01 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.437 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.53 -169.06 1.55 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -71.56 134.17 46.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.26 40.77 24.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.481 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.71 145.73 30.71 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.986 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.2 p30 -65.15 151.69 45.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.99 0.424 . . . . 0.0 110.594 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.47 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 7.6 p . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.783 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.445 -0.71 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.606 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 29.9 m -74.74 142.43 44.36 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -63.0 145.93 54.32 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -77.82 141.78 64.44 Favored Pre-proline 0 C--N 1.312 -1.038 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.599 -178.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.413 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 89.1 Cg_endo -102.68 39.02 4.46 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.17 -1.179 . . . . 0.0 113.941 1.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 55.3 m-85 -77.13 146.06 37.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 0.0 110.744 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -119.71 137.43 53.93 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.495 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 53.5 t -71.83 115.33 10.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.701 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.5 p -95.99 127.13 41.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.058 0.456 . . . . 0.0 110.964 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 95.4 m -116.52 69.92 0.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.444 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.4 pt -69.07 48.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 61.39 22.45 12.84 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.444 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 63.0 m-85 -140.48 131.37 26.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.008 0.433 . . . . 0.0 110.235 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.553 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 5.9 t80 -92.09 136.54 25.83 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.822 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 96.3 Cg_endo -88.19 170.39 35.06 Favored 'Cis proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.667 -1.389 . . . . 0.0 112.625 -0.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.2 m -78.91 178.5 7.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.6 p -156.27 128.38 7.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.299 -0.56 . . . . 0.0 112.282 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.5 m -69.4 124.42 23.83 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 31.9 mmt180 -118.58 158.8 46.23 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.027 0.829 . . . . 0.0 109.714 -179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 19.4 Cg_endo . . . . . 0 C--N 1.344 0.293 0 C-N-CA 122.523 2.149 . . . . 0.0 112.138 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 16' ' ' SER . 22.3 p . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 120.915 0.388 . . . . 0.0 109.997 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.422 HD13 ' O ' ' A' ' 8' ' ' ASP . 89.6 mt -82.5 132.05 35.21 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.2 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.69 -165.74 0.77 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 0.0 111.633 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.507 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 5.8 pt-20 -76.31 138.52 40.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.297 0.57 . . . . 0.0 111.14 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 63.31 39.48 9.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.964 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.405 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -109.82 138.74 45.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.011 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.422 ' O ' HD13 ' A' ' 3' ' ' LEU . 25.9 t70 -57.34 141.49 46.83 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.39 0.431 . . . . 0.0 110.488 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.0 p . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.55 0.69 . . . . 0.0 111.94 -179.207 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 2.3 m . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.2 m -76.29 144.68 40.12 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.353 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -63.93 148.72 48.85 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.4 ptmt -79.12 141.82 58.68 Favored Pre-proline 0 C--N 1.31 -1.118 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 88.0 Cg_endo -101.57 35.53 6.74 Favored 'Cis proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.995 -1.252 . . . . 0.0 113.599 0.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.848 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 25.6 m-85 -74.12 155.27 38.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -134.15 138.69 45.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.866 0.365 . . . . 0.0 111.689 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 49.9 t -68.85 120.81 15.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.576 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.3 p -102.05 124.72 48.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.279 0.561 . . . . 0.0 111.682 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 61.6 m -119.54 56.54 0.93 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.601 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.408 HG12 ' H ' ' A' ' 26' ' ' ILE . 17.2 pt -71.49 46.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 61.28 19.02 9.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.944 0.498 . . . . 0.0 112.08 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -120.9 131.92 54.66 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 50.0 t80 -91.63 129.03 44.09 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.127 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.512 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.6 Cg_endo -97.28 178.71 7.63 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.16 -1.183 . . . . 0.0 112.453 -0.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 75.4 m -78.86 151.06 32.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.3 p -149.77 134.75 17.91 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.979 -0.689 . . . . 0.0 112.247 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.2 m -67.66 130.59 43.5 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -122.3 151.42 59.11 Favored Pre-proline 0 C--N 1.32 -0.684 0 O-C-N 124.175 0.922 . . . . 0.0 110.076 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.848 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 38.4 Cg_exo . . . . . 0 N--CA 1.462 -0.364 0 C-N-CA 122.393 2.062 . . . . 0.0 110.48 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.8 p . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 80.2 mt -79.61 135.45 36.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.983 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.45 -166.82 0.92 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.174 0.511 . . . . 0.0 112.363 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.477 ' OE2' ' HB1' ' A' ' 4' ' ' ALA . 1.7 pm0 -73.78 132.36 42.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.058 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.73 38.37 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.544 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.85 141.46 36.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -64.93 148.85 50.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.111 0.481 . . . . 0.0 110.894 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.491 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.324 -0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 111.099 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.448 -0.528 0 CA-C-O 120.696 0.284 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 13.2 m -75.24 142.91 43.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.1 m -63.23 143.62 57.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.5 mtmt -78.14 144.45 67.22 Favored Pre-proline 0 C--N 1.313 -1.018 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.139 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.407 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 93.8 Cg_endo -101.19 40.09 4.31 Favored 'Cis proline' 0 N--CA 1.451 -0.989 0 C-N-CA 123.473 -1.47 . . . . 0.0 113.706 1.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.677 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 7.8 m-85 -77.48 145.03 37.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.894 0.378 . . . . 0.0 110.435 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.7 tp -120.23 137.54 54.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -71.27 120.77 17.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.883 179.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.4 p -103.88 129.04 51.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.05 0.452 . . . . 0.0 111.037 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.6 m -114.84 66.98 0.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.6 pt -70.28 47.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.91 22.06 12.24 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -129.71 133.26 46.95 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 20.2 t80 -92.38 128.6 44.11 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.171 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.4 Cg_endo -93.32 -177.89 8.18 Favored 'Cis proline' 0 N--CA 1.451 -1.016 0 C-N-CA 123.713 -1.369 . . . . 0.0 112.197 -0.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -78.55 171.56 14.94 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.7 p -152.95 128.93 10.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.6 m -69.3 127.13 31.95 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -117.63 149.65 45.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 124.038 0.836 . . . . 0.0 110.119 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.677 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.9 Cg_exo . . . . . 0 C--N 1.344 0.335 0 C-N-CA 122.898 2.399 . . . . 0.0 111.814 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.1 p . . . . . 0 N--CA 1.447 -0.603 0 CA-C-O 122.038 0.923 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.6 mt -79.61 130.1 35.07 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.62 -1.627 . . . . 0.0 111.065 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.36 -164.05 0.58 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.224 0.535 . . . . 0.0 112.203 -179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 8.3 pm0 -66.62 128.31 35.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.972 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.74 37.33 7.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.333 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -98.86 128.32 45.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -67.88 153.81 42.93 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.29 0.567 . . . . 0.0 111.902 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 4.0 p . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.634 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.636 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.8 m . . . . . 0 N--CA 1.452 -0.369 0 CA-C-O 120.733 0.302 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.4 m -73.37 146.83 44.88 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.19 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.411 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 63.3 m -63.02 140.59 58.89 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -77.99 141.78 63.67 Favored Pre-proline 0 C--N 1.312 -1.036 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.807 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -101.28 45.55 2.58 Favored 'Cis proline' 0 CA--C 1.538 0.712 0 C-N-CA 124.171 -1.179 . . . . 0.0 114.052 1.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 4.7 m-30 -79.47 148.46 31.88 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -128.29 134.79 49.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.131 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 2.5 t -75.19 116.56 16.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.462 0.648 . . . . 0.0 109.95 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.4 p -84.86 123.25 30.25 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.472 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.3 m -112.69 64.82 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.055 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.453 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.2 pt -70.93 47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 61.67 21.11 11.9 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.103 0.561 . . . . 0.0 112.417 178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -133.46 132.69 41.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.042 0.448 . . . . 0.0 109.892 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.535 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 12.6 t80 -91.83 133.62 30.4 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.895 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.535 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.91 174.14 15.44 Favored 'Cis proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.936 -1.277 . . . . 0.0 112.677 -0.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 57.3 m -79.1 164.24 24.45 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -147.46 124.61 11.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.96 -0.696 . . . . 0.0 112.678 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.3 m -65.48 124.59 22.7 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.832 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -111.01 149.31 40.26 Favored Pre-proline 0 C--N 1.318 -0.782 0 O-C-N 124.135 0.897 . . . . 0.0 108.849 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.592 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 27.5 Cg_endo . . . . . 0 N--CA 1.459 -0.558 0 C-N-CA 122.553 2.168 . . . . 0.0 110.408 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 81.2 mt -86.07 133.53 33.89 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.677 -178.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.533 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.53 -161.32 0.32 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.806 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.665 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -73.87 130.08 39.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.247 0.546 . . . . 0.0 111.395 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.26 38.9 7.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.736 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -101.17 137.32 39.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.959 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -61.32 142.95 56.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 1.8 p . . . . . 0 C--N 1.326 -0.416 0 CA-C-O 121.46 0.648 . . . . 0.0 111.503 -178.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 33.4 m -72.52 139.97 47.9 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.8 m -63.2 146.0 54.3 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.1 OUTLIER -78.58 139.74 59.11 Favored Pre-proline 0 C--N 1.311 -1.07 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.636 -179.064 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 86.8 Cg_endo -103.95 37.2 4.87 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.844 -1.315 . . . . 0.0 113.686 1.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.665 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 4.9 m-85 -66.73 156.56 35.04 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.397 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.4 tp -130.79 134.96 47.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.785 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.6 t -70.06 120.57 15.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.767 -0.652 . . . . 0.0 109.674 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.3 p -101.4 121.08 41.27 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.099 0.476 . . . . 0.0 111.666 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.3 m -112.12 62.57 0.62 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.0 tp -74.25 54.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 122.285 1.04 . . . . 0.0 112.445 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 55.95 23.46 6.67 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.373 -1.285 . . . . 0.0 112.897 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -128.77 133.62 48.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.019 0.438 . . . . 0.0 110.172 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.6 t80 -92.03 128.27 46.21 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.3 Cg_endo -95.69 179.61 8.22 Favored 'Cis proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.981 -1.258 . . . . 0.0 112.212 -0.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.82 162.04 26.37 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -147.67 129.87 15.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.431 -0.508 . . . . 0.0 112.263 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.5 m -69.0 127.53 33.47 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.555 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 36.4 mtt180 -116.85 160.19 37.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 123.768 0.667 . . . . 0.0 110.013 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.555 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 19.6 Cg_endo . . . . . 0 N--CA 1.462 -0.325 0 C-N-CA 122.284 1.99 . . . . 0.0 111.352 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.2 p . . . . . 0 N--CA 1.448 -0.542 0 CA-C-O 121.271 0.558 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 8' ' ' ASP . 90.5 mt -88.57 140.27 29.63 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.621 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.24 -177.07 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.052 0.453 . . . . 0.0 111.752 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.4 pt-20 -71.8 140.01 49.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.031 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 42.43 17.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.661 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.34 145.26 46.32 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.712 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.459 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.3 p30 -61.67 149.95 38.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.919 0.39 . . . . 0.0 110.947 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 C--N 1.327 -0.411 0 CA-C-O 121.787 0.803 . . . . 0.0 111.995 -179.081 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.607 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.6 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 14.6 m -65.13 144.04 57.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.544 0.211 . . . . 0.0 111.121 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.2 m -64.01 141.51 58.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -79.49 149.11 71.33 Favored Pre-proline 0 C--N 1.31 -1.117 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.936 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -96.71 34.4 8.89 Favored 'Cis proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.805 -1.748 . . . . 0.0 113.829 1.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.833 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 34.0 m-85 -77.94 145.17 36.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.872 0.367 . . . . 0.0 110.358 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -121.17 141.45 50.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.713 -178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.8 t -71.36 122.45 20.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.675 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -105.96 127.87 53.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 111.25 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.7 m -114.32 64.76 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 26' ' ' ILE . 9.9 tp -73.28 55.01 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.356 1.074 . . . . 0.0 112.484 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.11 23.67 7.15 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.366 -1.288 . . . . 0.0 112.992 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -127.91 132.95 49.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.991 0.424 . . . . 0.0 110.111 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 37.8 t80 -92.45 127.25 49.34 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.17 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.65 -177.7 7.81 Favored 'Cis proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.82 -1.325 . . . . 0.0 112.212 -0.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.15 165.18 24.27 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -149.51 131.97 15.7 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.487 -0.485 . . . . 0.0 112.037 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -70.18 132.37 45.68 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.506 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 30.1 mmt180 -126.74 160.63 57.71 Favored Pre-proline 0 C--N 1.322 -0.623 0 O-C-N 124.171 0.919 . . . . 0.0 109.016 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.833 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 18.8 Cg_endo . . . . . 0 C--N 1.343 0.279 0 C-N-CA 122.341 2.027 . . . . 0.0 111.17 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' N ' ' HD2' ' A' ' 1' ' ' LYS . 25.3 p -160.96 157.48 26.47 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.872 0.368 . . . . 0.0 110.5 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.452 ' HG ' ' HB3' ' A' ' 15' ' ' ASP . 86.4 mt -85.74 130.54 34.53 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.107 -179.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.423 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -78.92 -166.4 0.9 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.112 0.482 . . . . 0.0 112.269 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.3 pm0 -70.98 134.69 47.36 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.468 0.651 . . . . 0.0 111.438 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.18 38.8 10.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.623 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.92 47.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.638 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.5 139.05 57.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.259 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p -138.92 148.15 43.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.95 0.881 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 13' ' ' SER . 57.8 m -148.98 145.53 19.74 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 114.123 -1.399 . . . . 0.0 109.066 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.0 -47.29 24.23 Favored 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 123.798 2.999 . . . . 0.0 113.338 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -108.75 -51.48 2.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.034 0.445 . . . . 0.0 110.6 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.5 m -80.29 58.7 3.16 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.396 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -167.38 -135.61 1.89 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.235 -0.984 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.452 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 34.4 t0 -168.49 171.96 8.59 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.1 m -79.91 139.61 37.02 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 11.7 m -74.67 140.59 44.32 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 121.126 -0.23 . . . . 0.0 110.456 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 56.3 m -62.28 147.63 47.47 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -85.58 148.6 49.53 Favored Pre-proline 0 C--N 1.308 -1.213 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.22 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 96.2 Cg_endo -95.55 32.76 10.65 Favored 'Cis proline' 0 N--CA 1.45 -1.035 0 C-N-CA 122.895 -1.71 . . . . 0.0 113.684 1.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.75 ' HD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -75.32 145.5 41.72 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 tp -128.38 140.51 51.81 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.798 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.2 t -68.29 122.55 18.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.3 p -101.66 124.34 47.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.153 0.501 . . . . 0.0 111.26 -179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.2 m -119.48 66.25 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.549 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.439 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.3 pt -70.85 45.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 59.6 21.34 9.94 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.011 0.524 . . . . 0.0 111.932 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.439 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 23.8 m-85 -135.32 139.31 44.22 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 61.1 t80 -90.67 134.95 29.73 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.392 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 81.0 Cg_endo -98.92 168.74 10.29 Favored 'Cis proline' 0 N--CA 1.454 -0.851 0 C-N-CA 124.348 -1.105 . . . . 0.0 113.159 0.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.0 m -79.49 151.44 30.79 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.48 134.39 16.79 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.385 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 6.9 m -67.41 130.04 41.82 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -119.91 156.07 54.61 Favored Pre-proline 0 C--N 1.321 -0.672 0 O-C-N 123.858 0.724 . . . . 0.0 109.844 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.75 ' HA ' ' HD2' ' A' ' 21' ' ' TYR . 19.8 Cg_endo -61.74 149.91 88.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.458 2.105 . . . . 0.0 110.477 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 25.0 tptt -78.48 144.89 35.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.397 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.14 -33.22 1.93 Allowed Glycine 0 N--CA 1.443 -0.845 0 N-CA-C 108.021 -2.031 . . . . 0.0 108.021 -177.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 . . . . . 0 C--O 1.241 0.616 0 CA-C-N 113.979 -1.111 . . . . 0.0 108.298 177.186 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.0 pttp . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.0 p -161.33 159.63 28.67 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 123.428 0.455 . . . . 0.0 109.911 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 84.9 mt -79.68 126.13 30.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.69 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.55 -159.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.315 0.579 . . . . 0.0 112.503 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.802 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -65.88 127.61 32.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.095 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.53 42.22 11.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.713 -1.13 . . . . 0.0 110.941 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.79 120.7 42.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.791 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 58.1 m-20 -58.47 125.88 25.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.02 141.07 28.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.581 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.43 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 6.0 m -79.26 128.38 75.88 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.029 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.47 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 49.9 Cg_endo -68.63 -51.46 0.51 Allowed 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.055 2.503 . . . . 0.0 114.191 -178.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.2 m-90 -79.64 -51.18 9.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.641 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -159.89 134.07 7.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.489 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.43 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -178.42 -146.91 6.72 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.49 158.07 15.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.114 0.483 . . . . 0.0 111.131 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 m -92.42 149.59 21.31 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.589 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 28.9 m -69.39 142.78 53.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.625 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.6 m -66.09 146.23 54.9 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -79.45 140.43 55.99 Favored Pre-proline 0 C--N 1.31 -1.113 0 C-N-CA 120.689 -0.405 . . . . 0.0 110.361 -179.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 91.2 Cg_endo -102.99 41.66 3.22 Favored 'Cis proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.399 -1.084 . . . . 0.0 113.553 1.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.802 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 1.7 m-85 -71.68 144.0 49.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -117.64 133.73 55.63 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.297 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.5 t -71.06 122.46 20.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.4 p -102.14 126.35 49.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.105 0.478 . . . . 0.0 111.726 -178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.0 m -114.3 64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.044 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.4 pt -71.21 45.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.67 20.93 10.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.071 0.548 . . . . 0.0 112.243 178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -128.81 135.38 49.06 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.467 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 31.6 t80 -91.52 129.98 40.94 Favored Pre-proline 0 C--N 1.316 -0.89 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.944 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 97.1 Cg_endo -97.18 178.51 7.81 Favored 'Cis proline' 0 N--CA 1.451 -1.013 0 C-N-CA 124.042 -1.232 . . . . 0.0 112.714 -0.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 62.1 m -79.62 149.89 31.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 1.4 p -138.96 135.63 34.56 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.49 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.0 m -67.0 127.08 31.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.503 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -112.56 146.0 34.1 Favored Pre-proline 0 C--N 1.321 -0.651 0 O-C-N 123.968 0.793 . . . . 0.0 109.936 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 20.5 Cg_exo -60.41 146.91 95.78 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.361 2.041 . . . . 0.0 110.248 178.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 31.1 tptt -79.37 140.47 37.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.362 -179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.23 31.38 0.12 Allowed Glycine 0 C--N 1.314 -0.646 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.836 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.26 1.647 0 CA-C-O 117.086 -1.435 . . . . 0.0 107.245 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.593 ' HG3' ' OD2' ' A' ' 15' ' ' ASP . 17.4 tptm . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.2 p -161.79 160.99 28.96 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 123.271 0.357 . . . . 0.0 110.171 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.4 mt -79.52 127.54 32.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.502 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.17 -161.07 0.28 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.253 0.549 . . . . 0.0 111.844 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.684 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 4.5 pt-20 -73.15 132.65 43.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.511 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 64.39 40.99 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.26 -178.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -107.17 132.85 52.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.74 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.01 132.24 50.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.959 0.409 . . . . 0.0 110.794 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.7 m -89.94 153.47 20.59 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.361 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.0 m -78.62 129.17 75.0 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.123 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.47 -55.13 2.32 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.409 2.739 . . . . 0.0 113.906 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -91.19 -57.03 2.93 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.344 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.6 m -161.37 145.63 13.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.075 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 173.06 -144.39 7.79 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 121.124 -0.56 . . . . 0.0 111.754 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.593 ' OD2' ' HG3' ' A' ' 1' ' ' LYS . 0.5 OUTLIER -68.0 150.35 48.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.376 0.608 . . . . 0.0 111.448 179.555 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.1 m -103.1 146.85 27.77 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.757 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.552 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 34.6 m -66.18 137.8 57.25 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 59.7 m -62.92 156.86 23.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 24.1 mmmt -97.26 150.18 36.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 C-N-CA 119.893 -0.723 . . . . 0.0 110.454 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.546 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 98.1 Cg_endo -93.92 35.26 7.87 Favored 'Cis proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.137 -1.61 . . . . 0.0 113.707 1.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 16.2 m-85 -68.47 154.93 40.9 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.856 0.36 . . . . 0.0 110.314 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -134.41 136.19 43.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.809 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.6 t -74.18 120.3 19.57 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -87.51 127.85 35.24 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.7 m -129.86 75.91 1.69 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.938 0.774 . . . . 0.0 109.145 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.7 pt -71.46 43.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 60.42 16.53 6.41 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.36 0.664 . . . . 0.0 112.081 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.399 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.743 ' CG ' ' HA ' ' A' ' 30' ' ' PRO . 6.7 t80 -80.44 151.77 72.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.743 ' HA ' ' CG ' ' A' ' 29' ' ' TYR . 10.8 Cg_endo -90.79 138.06 10.72 Favored 'Cis proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.599 -1.0 . . . . 0.0 114.192 1.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 67.9 m -79.25 139.29 37.93 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 177.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -145.01 140.03 27.88 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.213 -0.995 . . . . 0.0 113.099 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.3 129.18 39.16 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -117.23 151.03 47.31 Favored Pre-proline 0 C--N 1.323 -0.587 0 O-C-N 124.263 0.977 . . . . 0.0 109.662 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 16.5 Cg_exo -60.29 150.96 77.23 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.604 2.202 . . . . 0.0 110.907 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 36' ' ' LYS . 1.5 tppt? -78.54 126.37 30.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.964 0.888 . . . . 0.0 109.58 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.49 ' H ' ' HD3' ' A' ' 36' ' ' LYS . . . 141.78 -24.45 2.45 Favored Glycine 0 N--CA 1.442 -0.915 0 N-CA-C 105.779 -2.928 . . . . 0.0 105.779 -175.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 . . . . . 0 N--CA 1.443 -0.798 0 CA-C-N 112.492 -1.854 . . . . 0.0 107.216 176.911 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.2 tptm . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.1 p -161.59 158.81 26.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.742 0.306 . . . . 0.0 110.337 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.528 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 61.8 mt -79.7 133.64 36.37 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.83 -164.59 0.61 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.393 0.616 . . . . 0.0 112.004 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.635 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 56.4 tt0 -70.65 132.68 45.79 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.176 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.47 49.17 8.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.168 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -122.42 129.94 52.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.756 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 1.9 m-20 -54.79 126.99 26.4 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.241 0.543 . . . . 0.0 111.821 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 0.3 OUTLIER -102.96 148.37 25.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.319 179.732 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.0 m -79.29 126.29 81.68 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.983 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.415 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 37.3 Cg_endo -66.38 -57.02 0.24 Allowed 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.992 2.461 . . . . 0.0 114.015 -178.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.415 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 23.9 m-90 -79.9 -54.14 6.1 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -178.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.3 m -159.32 139.54 12.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.583 0.23 . . . . 0.0 110.908 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 166.44 -152.18 21.01 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.458 -0.657 . . . . 0.0 111.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -70.43 142.74 51.97 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.129 0.49 . . . . 0.0 110.422 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 m -94.17 148.48 22.14 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.429 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 34.6 m -67.55 139.92 56.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.327 0.108 . . . . 0.0 110.964 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.2 m -65.16 138.99 58.62 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -79.43 149.41 72.01 Favored Pre-proline 0 C--N 1.31 -1.137 0 C-N-CA 120.286 -0.566 . . . . 0.0 110.454 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.5 Cg_endo -96.44 37.74 6.04 Favored 'Cis proline' 0 N--CA 1.451 -0.984 0 C-N-CA 123.041 -1.65 . . . . 0.0 113.81 1.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.56 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 6.6 m-85 -74.55 146.53 42.55 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.108 0.48 . . . . 0.0 110.244 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.5 tp -118.99 139.3 51.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.43 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 52.8 t -73.23 128.66 36.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.549 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.3 p -112.47 128.02 56.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.107 0.48 . . . . 0.0 111.481 -179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 86.6 m -111.87 67.05 0.64 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.248 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.424 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 18.0 pt -69.87 48.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 60.39 21.95 11.53 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.5 m-85 -132.91 133.26 43.02 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 20.1 t80 -91.92 130.32 38.9 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.008 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 37.7 Cg_endo -94.79 178.67 9.64 Favored 'Cis proline' 0 N--CA 1.448 -1.15 0 C-N-CA 123.927 -1.281 . . . . 0.0 112.566 -0.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 37.5 m -79.21 156.41 28.18 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.403 ' HA ' ' HA ' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -141.29 135.52 30.68 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.972 -179.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.0 m -68.1 132.29 46.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.705 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -122.7 155.77 62.62 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 124.293 0.996 . . . . 0.0 108.997 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.635 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 18.9 Cg_endo -60.29 150.43 80.2 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.357 2.038 . . . . 0.0 110.388 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 17.6 tptt -78.56 140.51 38.49 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.397 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.2 -33.19 1.93 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 -177.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 . . . . . 0 C--O 1.242 0.687 0 CA-C-N 113.946 -1.127 . . . . 0.0 108.309 177.049 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 16' ' ' SER . 29.7 p -149.62 157.74 43.53 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.955 0.407 . . . . 0.0 110.287 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.562 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 55.9 mt -91.39 122.73 34.26 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.335 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.58 -160.25 0.25 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.284 0.564 . . . . 0.0 112.278 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.666 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 3.9 pm0 -65.97 125.82 26.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.935 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.54 37.78 12.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.062 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -99.85 136.07 40.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -65.2 136.59 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.351 0.596 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.562 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 7.2 m -90.74 156.09 18.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.847 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.475 ' OG ' ' HA3' ' A' ' 14' ' ' GLY . 15.4 m -78.74 140.46 58.91 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.957 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.455 ' HB2' ' CE3' ' A' ' 12' ' ' TRP . 21.6 Cg_exo -65.09 -59.55 0.15 Allowed 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.925 2.417 . . . . 0.0 113.668 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.455 ' CE3' ' HB2' ' A' ' 11' ' ' PRO . 17.5 m-90 -113.08 -34.94 5.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.692 -178.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m -155.69 141.08 17.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.61 0.243 . . . . 0.0 111.033 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' HA3' ' OG ' ' A' ' 10' ' ' SER . . . 167.14 -146.03 10.39 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.72 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -87.49 145.51 26.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.0 110.82 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.429 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 14.8 m -93.74 155.64 17.12 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.727 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 36.6 m -59.83 139.01 57.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.564 0.221 . . . . 0.0 111.104 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.434 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 58.3 m -65.68 148.62 51.45 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.2 OUTLIER -79.72 139.52 54.43 Favored Pre-proline 0 C--N 1.311 -1.079 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.179 179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 62.9 Cg_endo -106.74 46.56 1.9 Allowed 'Cis proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.167 -1.18 . . . . 0.0 113.579 1.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.666 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 3.4 m-85 -72.19 -165.0 0.16 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.196 -0.315 . . . . 0.0 110.884 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.3 tp -167.55 134.95 2.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.666 0.27 . . . . 0.0 110.889 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 35.6 t -72.96 128.64 36.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.696 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.2 p -111.19 127.78 55.7 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.066 0.46 . . . . 0.0 110.71 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 93.1 m -108.02 65.32 0.63 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.541 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 20.2 pt -70.29 47.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.189 -178.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 61.33 25.35 15.33 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.231 0.612 . . . . 0.0 112.649 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 16.3 m-85 -132.08 132.55 43.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 0.0 110.202 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.496 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 34.3 t80 -92.59 125.93 53.97 Favored Pre-proline 0 C--N 1.317 -0.823 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.367 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.496 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.4 Cg_endo -93.41 179.6 10.3 Favored 'Cis proline' 0 N--CA 1.45 -1.05 0 C-N-CA 123.945 -1.273 . . . . 0.0 112.133 -0.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 23' ' ' CYS . 34.4 m -78.17 163.5 25.77 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 p -144.6 136.55 25.97 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.393 -0.523 . . . . 0.0 112.234 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.6 m -70.65 131.36 43.8 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.167 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -119.61 153.06 54.07 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.503 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 27.1 Cg_exo -57.93 153.93 41.53 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.251 1.968 . . . . 0.0 110.181 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 0.9 OUTLIER -77.38 120.5 22.47 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.927 -178.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.17 -27.45 2.41 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.5 m-90 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.559 -0.734 . . . . 0.0 109.174 178.359 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.459 ' HZ2' ' CG ' ' A' ' 15' ' ' ASP . 7.5 mtmp? . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 16' ' ' SER . 30.4 p -151.61 153.62 34.84 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.048 0.452 . . . . 0.0 110.37 178.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.497 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -83.6 129.08 34.96 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.855 -178.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.539 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.83 -162.74 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.541 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.84 129.36 38.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.206 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.01 40.21 9.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.682 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.421 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.27 135.35 45.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.261 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 140.41 57.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.285 0.564 . . . . 0.0 111.104 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.0 m -101.54 149.05 24.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.276 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.7 m -79.11 130.45 69.47 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.95 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.47 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 32.9 Cg_endo -64.29 -53.83 1.01 Allowed 'Trans proline' 0 CA--C 1.529 0.265 0 C-N-CA 123.101 2.534 . . . . 0.0 114.162 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 22.0 m-90 -79.62 -50.21 11.01 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.628 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.3 p -171.12 141.0 1.59 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.796 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -176.93 -166.48 33.98 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.459 ' CG ' ' HZ2' ' A' ' 1' ' ' LYS . 3.5 m-20 -68.95 142.15 54.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.922 0.391 . . . . 0.0 110.71 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.436 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 16.2 m -81.88 153.32 26.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.256 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 18.4 m -64.01 138.3 58.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.827 -0.169 . . . . 0.0 111.174 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.0 m -62.51 146.05 52.67 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -82.39 147.18 55.84 Favored Pre-proline 0 C--N 1.309 -1.164 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.172 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.605 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.9 Cg_endo -98.0 36.79 6.66 Favored 'Cis proline' 0 N--CA 1.45 -1.087 0 C-N-CA 122.997 -1.668 . . . . 0.0 113.686 1.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.541 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 15.0 m-85 -77.8 147.28 35.33 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.032 0.444 . . . . 0.0 110.596 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -126.49 142.36 51.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.999 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.1 t -72.39 126.2 29.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.321 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.6 p -104.25 130.17 52.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.051 0.453 . . . . 0.0 110.958 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.5 m -114.51 65.79 0.67 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.39 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.862 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.49 43.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 62.81 22.29 13.31 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 123.103 0.561 . . . . 0.0 112.319 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -125.69 133.38 52.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -92.04 126.99 51.25 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.277 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -95.36 179.89 8.28 Favored 'Cis proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.961 -1.266 . . . . 0.0 112.257 -0.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 63.4 m -78.13 159.48 28.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.0 p -146.87 135.54 22.09 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.543 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.655 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.9 m -67.84 130.02 41.71 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.777 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -126.68 154.11 75.64 Favored Pre-proline 0 C--N 1.323 -0.579 0 O-C-N 124.456 1.098 . . . . 0.0 108.919 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.492 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 46.7 Cg_exo -54.05 150.03 32.97 Favored 'Trans proline' 0 N--CA 1.465 -0.171 0 C-N-CA 122.648 2.232 . . . . 0.0 111.576 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 13.4 ttpp -77.92 68.1 3.91 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.234 0.54 . . . . 0.0 110.047 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.78 -5.75 2.57 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 . . . . . 0 C--O 1.251 1.18 0 CA-C-O 117.723 -1.132 . . . . 0.0 110.542 -179.414 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.501 ' HG3' ' CG ' ' A' ' 15' ' ' ASP . 1.9 ptmm? . . . . . 0 N--CA 1.486 1.345 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.0 p -137.09 163.2 31.35 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.968 0.413 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.495 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 77.6 mt -102.11 127.32 49.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.484 -178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.25 -161.1 0.29 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.314 0.578 . . . . 0.0 112.456 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.585 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 10.3 pm0 -66.31 129.53 40.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.98 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.05 41.26 14.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.671 -1.149 . . . . 0.0 111.074 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -104.64 132.36 50.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.621 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.87 134.81 56.63 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.593 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -127.55 137.66 52.68 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.966 0.889 . . . . 0.0 112.206 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.445 ' HB2' ' HA3' ' A' ' 14' ' ' GLY . 19.6 m -88.52 141.23 30.24 Favored Pre-proline 0 C--N 1.315 -0.926 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.782 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.55 -37.36 90.43 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 123.264 2.642 . . . . 0.0 113.494 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 13.7 m-90 -135.95 -60.77 0.72 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.92 0.39 . . . . 0.0 111.384 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -76.72 66.14 2.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.751 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' HA3' ' HB2' ' A' ' 10' ' ' SER . . . -162.8 151.85 21.8 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.727 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.501 ' CG ' ' HG3' ' A' ' 1' ' ' LYS . 21.6 m-20 -60.22 148.68 35.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.962 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 6.7 m -79.03 147.46 32.84 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 12.4 m -64.52 140.62 58.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.529 0.204 . . . . 0.0 111.194 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.8 m -63.01 143.56 57.66 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -80.45 147.81 64.78 Favored Pre-proline 0 C--N 1.308 -1.229 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.803 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.759 ' HB2' ' HD2' ' A' ' 36' ' ' LYS . 93.7 Cg_endo -97.55 34.53 8.66 Favored 'Cis proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.893 -1.711 . . . . 0.0 114.017 1.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.597 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 22.0 m-85 -76.13 161.59 28.71 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.406 HD23 ' HH2' ' A' ' 38' ' ' TRP . 60.5 tp -141.8 140.46 33.01 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.906 0.384 . . . . 0.0 111.496 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.2 t -67.59 132.5 47.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.857 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 82.3 p -119.5 128.66 54.17 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.298 0.57 . . . . 0.0 111.654 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 88.4 m -115.87 64.9 0.7 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.1 pt -69.81 48.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 59.39 20.74 9.05 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.032 0.533 . . . . 0.0 112.23 178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.441 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -134.68 136.06 42.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.061 0.458 . . . . 0.0 110.019 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 43.4 t80 -90.79 134.42 30.54 Favored Pre-proline 0 C--N 1.315 -0.915 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.488 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 60.9 Cg_endo -97.39 172.5 11.22 Favored 'Cis proline' 0 N--CA 1.453 -0.863 0 C-N-CA 124.236 -1.152 . . . . 0.0 113.106 0.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 66.5 m -79.08 146.21 33.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.3 137.36 21.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.109 -0.636 . . . . 0.0 112.272 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.3 m -66.5 129.94 41.53 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.637 ' HB2' ' CE3' ' A' ' 38' ' ' TRP . 21.5 mmt85 -119.7 160.68 41.34 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.597 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.8 Cg_endo -58.54 159.79 19.01 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.452 2.101 . . . . 0.0 111.569 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.759 ' HD2' ' HB2' ' A' ' 20' ' ' PRO . 51.9 tttp -77.97 77.76 4.47 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.692 0.758 . . . . 0.0 109.767 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.7 47.36 0.05 OUTLIER Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.988 -178.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.637 ' CE3' ' HB2' ' A' ' 34' ' ' ARG . 3.4 p90 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.112 -0.947 . . . . 0.0 111.006 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 27.2 tptp . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -160.54 157.74 27.96 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.689 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 79.8 mt -79.24 134.62 36.65 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.904 -178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.465 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.39 -166.48 0.86 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.212 0.529 . . . . 0.0 112.403 -178.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.769 ' HB2' ' HG3' ' A' ' 35' ' ' PRO . 1.8 pm0 -73.09 129.64 38.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.13 37.08 14.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.608 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.94 140.14 36.63 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.632 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -62.9 148.73 46.45 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.138 0.494 . . . . 0.0 111.023 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -139.6 148.31 42.32 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.277 -179.601 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 9.4 m -79.68 130.59 67.11 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.06 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.463 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 48.2 Cg_endo -66.38 -48.35 2.49 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.299 2.666 . . . . 0.0 114.078 -178.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.463 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 15.7 m-90 -79.39 -51.99 8.67 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.5 m -160.95 137.05 8.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.134 -179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.19 -156.13 16.64 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.39 150.86 41.44 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.223 0.535 . . . . 0.0 110.657 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.1 m -85.7 145.73 27.15 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.403 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.476 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 9.1 m -73.89 140.51 45.73 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.1 m -61.71 143.11 56.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.9 ptpt -77.76 142.02 65.06 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.773 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 85.5 Cg_endo -101.46 41.34 3.62 Favored 'Cis proline' 0 CA--C 1.538 0.715 0 C-N-CA 124.088 -1.213 . . . . 0.0 113.935 1.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.665 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 5.9 m-85 -78.25 147.65 34.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.4 tp -127.17 136.94 52.78 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 48.7 t -67.52 124.85 24.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.993 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.5 p -110.18 126.81 54.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.101 0.477 . . . . 0.0 111.146 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 98.1 m -114.31 65.62 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.442 ' O ' HG12 ' A' ' 26' ' ' ILE . 16.3 tt -72.67 47.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.047 0.927 . . . . 0.0 112.358 -178.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 59.93 23.13 12.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.993 -1.003 . . . . 0.0 112.481 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -126.61 133.91 50.92 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 38.4 t80 -92.08 126.98 51.22 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.336 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.4 Cg_endo -95.49 -178.93 7.41 Favored 'Cis proline' 0 N--CA 1.452 -0.936 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.363 -0.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.7 m -78.55 164.07 25.0 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -150.59 130.46 13.31 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.26 -0.576 . . . . 0.0 112.397 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 19.1 m -69.28 121.91 17.82 Favored 'General case' 0 CA--C 1.51 -0.578 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HA ' ' HD3' ' A' ' 34' ' ' ARG . 21.6 mmt180 -103.55 147.77 34.72 Favored Pre-proline 0 C--N 1.321 -0.656 0 O-C-N 123.926 0.766 . . . . 0.0 110.216 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.769 ' HG3' ' HB2' ' A' ' 5' ' ' GLU . 10.6 Cg_exo -63.32 147.28 93.79 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.53 2.153 . . . . 0.0 110.929 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HD3' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -79.26 136.26 37.0 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 119.573 -0.851 . . . . 0.0 109.461 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.592 ' N ' ' HD3' ' A' ' 36' ' ' LYS . . . 142.01 -32.98 1.97 Allowed Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 106.847 -2.501 . . . . 0.0 106.847 -176.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.422 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 3.8 m-90 . . . . . 0 C--O 1.264 1.825 0 CA-C-N 113.26 -1.47 . . . . 0.0 107.567 176.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -160.7 160.86 31.97 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 123.507 0.504 . . . . 0.0 110.311 -179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 84.9 mt -79.87 133.24 36.23 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.229 -179.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.507 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.21 -163.55 0.51 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.074 0.464 . . . . 0.0 112.212 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.592 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -72.64 131.53 42.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.327 0.584 . . . . 0.0 111.201 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.92 38.44 11.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.448 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.411 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.82 135.33 42.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.973 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 16.5 t70 -59.71 141.07 55.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.046 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.7 OUTLIER -139.42 138.47 36.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.951 0.882 . . . . 0.0 111.977 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.9 m -89.17 143.6 31.3 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.906 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.9 -37.29 77.36 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.623 2.882 . . . . 0.0 113.587 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 14.2 m-90 -133.73 -57.12 0.88 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.981 0.42 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.0 p -79.82 60.7 3.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.737 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -147.41 158.14 27.62 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.505 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.428 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 3.5 t0 -67.56 161.26 26.0 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.8 m -85.06 145.26 27.76 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.4 m -72.67 139.45 47.29 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.402 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 73.3 m -61.8 144.25 55.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.82 ' HD3' ' H ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.05 142.46 64.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.768 -178.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.486 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 90.6 Cg_endo -101.87 35.94 6.37 Favored 'Cis proline' 0 N--CA 1.453 -0.88 0 C-N-CA 123.298 -1.542 . . . . 0.0 113.677 0.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 10.0 m-85 -71.36 153.49 42.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.4 tp -133.03 138.91 46.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.488 -0.323 . . . . 0.0 111.603 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 42.6 t -68.5 122.48 18.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.646 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 65.5 p -101.99 126.07 48.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.116 0.484 . . . . 0.0 111.457 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 68.7 m -117.38 66.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.1 pt -70.37 46.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.74 21.37 10.15 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.012 0.525 . . . . 0.0 112.148 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.458 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 28.9 m-85 -136.27 138.21 41.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.073 0.463 . . . . 0.0 109.937 179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 40.4 t80 -90.77 135.43 28.98 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.539 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.508 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 83.0 Cg_endo -97.97 170.53 11.22 Favored 'Cis proline' 0 N--CA 1.454 -0.828 0 C-N-CA 124.129 -1.196 . . . . 0.0 113.138 0.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 84.6 m -79.32 151.93 30.77 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.4 p -149.58 134.31 17.75 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.532 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.6 m -66.21 127.06 30.69 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.521 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 27.0 mmt180 -118.26 160.95 37.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 O-C-N 124.0 0.813 . . . . 0.0 109.25 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.7 Cg_endo -58.6 156.81 30.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.616 2.211 . . . . 0.0 111.676 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' A' ' 20' ' ' PRO . 47.8 tptt -77.74 115.36 17.43 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.88 47.24 2.12 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.416 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 4.7 p90 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.491 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.533 ' HG2' ' OD2' ' A' ' 15' ' ' ASP . 26.2 ttpp . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p -162.05 163.52 28.7 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 123.548 0.53 . . . . 0.0 109.893 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.4 mt -79.89 128.31 33.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.069 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.5 -162.3 0.4 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.201 0.524 . . . . 0.0 111.796 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.787 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 6.6 pm0 -64.57 128.1 34.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.953 -179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.27 47.63 3.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.628 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -115.87 126.22 53.67 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.118 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.32 128.26 30.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 112.068 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 p -122.23 156.24 34.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.054 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.502 ' HB3' ' C ' ' A' ' 13' ' ' SER . 46.8 t -160.77 144.1 9.89 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.347 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -53.2 -33.13 63.3 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.65 2.9 . . . . 0.0 112.873 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -123.05 -48.9 1.98 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.944 0.402 . . . . 0.0 110.723 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.502 ' C ' ' HB3' ' A' ' 10' ' ' SER . 2.4 p -88.54 47.22 1.47 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.632 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -170.96 148.48 11.32 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.548 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.533 ' OD2' ' HG2' ' A' ' 1' ' ' LYS . 27.5 t0 -82.63 175.55 10.07 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.1 m -79.85 140.16 36.89 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 60.5 m -71.59 142.57 50.0 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.571 0.224 . . . . 0.0 110.78 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 94.0 m -68.22 143.84 55.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.769 ' H ' ' HD3' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.83 144.23 59.59 Favored Pre-proline 0 C--N 1.312 -1.039 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.545 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 74.5 Cg_endo -103.18 38.94 4.34 Favored 'Cis proline' 0 N--CA 1.45 -1.071 0 C-N-CA 123.785 -1.339 . . . . 0.0 113.688 1.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.787 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.9 m-85 -69.47 160.51 31.28 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.9 tp -125.04 134.79 52.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.872 0.368 . . . . 0.0 111.337 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 52.7 t -74.88 116.69 15.89 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.0 p -96.9 126.42 42.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.079 0.466 . . . . 0.0 111.457 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 83.3 m -117.63 66.59 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.118 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.458 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.1 tp -73.66 53.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 122.408 1.099 . . . . 0.0 112.408 -178.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.57 23.11 7.3 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.335 -1.302 . . . . 0.0 112.884 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.59 134.18 48.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.897 0.379 . . . . 0.0 110.153 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 t80 -92.26 128.55 44.56 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.936 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 72.6 Cg_endo -94.77 -179.29 8.18 Favored 'Cis proline' 0 N--CA 1.449 -1.094 0 C-N-CA 123.84 -1.317 . . . . 0.0 112.304 -0.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.1 m -79.25 171.82 14.66 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -153.42 129.96 10.69 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.261 -0.575 . . . . 0.0 111.855 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 3.7 m -68.31 127.5 33.17 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -120.0 147.2 43.91 Favored Pre-proline 0 C--N 1.319 -0.738 0 O-C-N 123.764 0.665 . . . . 0.0 109.302 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.521 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 34.6 Cg_exo -58.33 152.27 54.79 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.303 2.002 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HE2' ' HB2' ' A' ' 20' ' ' PRO . 21.0 ttmm -77.57 122.54 25.41 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.015 -0.674 . . . . 0.0 109.785 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.11 -30.7 2.23 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.481 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 6.1 m-90 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.584 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -160.6 156.63 25.98 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.868 0.366 . . . . 0.0 110.17 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 82.6 mt -82.83 131.42 35.2 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.448 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.23 -161.97 0.36 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.523 ' OE2' ' HD3' ' A' ' 35' ' ' PRO . 16.7 tp10 -68.2 134.77 50.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.273 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.42 49.16 13.41 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.308 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.415 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -117.59 124.08 47.77 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.134 -0.626 . . . . 0.0 112.069 -178.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.42 ' OD1' ' HB3' ' A' ' 32' ' ' SER . 75.6 m-20 -54.59 126.17 22.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.246 0.545 . . . . 0.0 111.183 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' HD12 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -111.89 154.65 24.88 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.136 -178.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 27.7 t -137.09 136.77 21.38 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.749 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.2 -30.5 71.69 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 123.463 2.775 . . . . 0.0 113.607 -178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 14.0 m-90 -132.73 -48.34 0.88 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.873 0.368 . . . . 0.0 111.398 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.3 t -83.25 52.24 2.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.504 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.45 147.26 7.52 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.824 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.49 160.53 24.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.902 0.382 . . . . 0.0 110.456 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 m -78.9 148.82 32.59 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 22.1 m -65.1 136.43 56.72 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.434 0.159 . . . . 0.0 111.309 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 62.9 m -61.4 141.67 57.48 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.642 ' HE3' ' HA ' ' A' ' 20' ' ' PRO . 25.9 mmmt -79.8 151.28 73.62 Favored Pre-proline 0 C--N 1.308 -1.204 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.248 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.642 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 88.6 Cg_endo -94.38 30.21 14.27 Favored 'Cis proline' 0 N--CA 1.452 -0.969 0 C-N-CA 122.808 -1.747 . . . . 0.0 114.022 1.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 5' ' ' GLU . 27.8 m-85 -71.12 163.69 27.11 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.698 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 tp -139.85 142.3 36.59 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.16 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 43.8 t -69.61 129.09 38.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.727 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 90.6 p -114.51 127.93 56.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.145 0.497 . . . . 0.0 111.365 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 96.7 m -113.76 66.24 0.66 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.35 -0.841 . . . . 0.0 108.777 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 16.0 pt -69.84 47.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -178.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.04 22.79 11.97 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.167 0.587 . . . . 0.0 112.514 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 19.1 m-85 -133.55 135.64 44.46 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.911 0.386 . . . . 0.0 109.98 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 36.0 t80 -91.53 130.22 40.08 Favored Pre-proline 0 C--N 1.315 -0.908 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.914 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 57.6 Cg_endo -96.92 178.05 8.25 Favored 'Cis proline' 0 N--CA 1.451 -1.008 0 C-N-CA 124.202 -1.166 . . . . 0.0 112.734 -0.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.5 m -79.48 151.51 30.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.42 ' HB3' ' OD1' ' A' ' 8' ' ' ASP . 0.7 OUTLIER -144.3 138.4 27.88 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.734 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.3 m -67.58 133.66 49.82 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.908 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.63 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 22.0 mmt85 -130.72 169.07 14.55 Favored Pre-proline 0 C--O 1.236 0.387 0 O-C-N 125.193 1.558 . . . . 0.0 107.776 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.63 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 29.6 Cg_endo -63.09 157.96 46.42 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 121.931 1.754 . . . . 0.0 111.85 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 48.9 tttm -78.25 72.17 4.77 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.802 0.81 . . . . 0.0 109.829 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.61 46.66 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.285 -1.325 . . . . 0.0 109.917 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.577 ' CE3' ' HB2' ' A' ' 34' ' ' ARG . 4.8 p90 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.903 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.3 tptm . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -162.84 161.53 26.05 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.372 0.42 . . . . 0.0 110.361 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 89.2 mt -79.99 136.82 36.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.648 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.03 -163.22 0.46 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.329 0.585 . . . . 0.0 112.302 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.608 ' HG3' ' HD3' ' A' ' 35' ' ' PRO . 36.1 tt0 -74.74 133.26 42.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.533 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.95 43.54 9.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.14 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.88 137.64 45.53 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.381 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.73 135.31 57.65 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.192 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -126.31 141.43 51.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.766 0.793 . . . . 0.0 112.485 -179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.458 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 46.9 t -160.24 137.51 6.87 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.018 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 32.7 Cg_exo -62.19 -49.34 6.43 Favored 'Trans proline' 0 N--CA 1.472 0.247 0 C-N-CA 122.941 2.428 . . . . 0.0 113.59 -178.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -102.08 10.71 39.29 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.671 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 10' ' ' SER . 28.8 m -156.03 51.77 0.55 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.117 0.484 . . . . 0.0 110.947 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.88 -133.02 1.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -166.26 -174.07 2.78 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -90.21 137.44 32.34 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 20.9 m -69.5 138.03 53.03 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.918 -0.128 . . . . 0.0 111.029 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.0 m -62.96 142.88 58.18 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -80.38 149.04 68.1 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.447 -179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 90.5 Cg_endo -96.36 37.64 6.1 Favored 'Cis proline' 0 N--CA 1.453 -0.861 0 C-N-CA 123.061 -1.641 . . . . 0.0 113.646 1.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.55 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 7.0 m-85 -77.13 148.91 35.75 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.169 0.509 . . . . 0.0 110.928 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 58.9 tp -126.76 140.73 52.16 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.292 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 51.9 t -69.65 121.92 18.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.867 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.9 p -96.76 122.64 39.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.3 m -121.22 59.22 0.95 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.593 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.1 pt -71.27 46.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 59.44 20.63 9.0 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.004 0.522 . . . . 0.0 111.996 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -128.17 136.01 50.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.063 0.459 . . . . 0.0 109.937 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.47 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 46.0 t80 -91.08 132.81 33.24 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.529 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 90.5 Cg_endo -99.05 172.05 9.24 Favored 'Cis proline' 0 N--CA 1.453 -0.859 0 C-N-CA 124.372 -1.095 . . . . 0.0 113.128 -0.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.4 m -79.25 149.08 31.97 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.4 p -150.92 134.52 16.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.769 -0.772 . . . . 0.0 112.622 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.6 m -64.58 127.95 33.71 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 23.0 mmt180 -120.01 159.47 46.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.432 1.082 . . . . 0.0 109.418 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.608 ' HD3' ' HG3' ' A' ' 5' ' ' GLU . 23.0 Cg_endo -62.43 152.68 75.68 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.376 2.051 . . . . 0.0 111.187 179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 55.4 tttm -77.63 119.01 20.59 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.003 0.43 . . . . 0.0 110.125 -179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.61 -28.97 2.28 Favored Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.568 178.975 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.3 p -160.35 156.05 25.62 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.924 0.392 . . . . 0.0 110.327 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.563 ' CD1' ' HA ' ' A' ' 9' ' ' CYS . 78.5 mt -80.64 126.14 30.89 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.16 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.437 ' HB1' ' OE1' ' A' ' 5' ' ' GLU . . . -79.18 -164.99 0.69 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.038 0.446 . . . . 0.0 111.86 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.572 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.7 pm0 -68.42 129.85 41.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.303 0.573 . . . . 0.0 111.235 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.9 40.37 5.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.91 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -110.05 124.46 51.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.596 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -62.29 130.03 43.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.431 0.634 . . . . 0.0 111.543 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.563 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 2.8 m -81.2 154.3 26.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.79 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.7 m -79.05 128.2 77.04 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.915 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.481 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 30.6 Cg_endo -64.12 -53.86 1.05 Allowed 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 123.114 2.542 . . . . 0.0 113.738 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.481 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 14.8 m-90 -79.92 -51.78 8.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.69 0.281 . . . . 0.0 111.172 -179.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.8 t -176.97 148.49 0.64 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.576 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 174.26 -148.4 9.89 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.843 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -74.92 145.29 42.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.373 0.606 . . . . 0.0 111.149 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -90.06 155.89 18.76 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.642 178.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 27.6 m -65.63 139.54 58.43 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 121.33 -0.148 . . . . 0.0 110.77 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.449 ' O ' ' HD1' ' A' ' 21' ' ' TYR . 57.6 m -65.38 146.65 54.63 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -79.55 140.43 55.61 Favored Pre-proline 0 C--N 1.31 -1.12 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -102.2 42.48 3.12 Favored 'Cis proline' 0 N--CA 1.455 -0.776 0 C-N-CA 124.413 -1.078 . . . . 0.0 113.543 0.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.704 ' CD2' ' HA ' ' A' ' 35' ' ' PRO . 13.4 m-85 -79.69 143.65 34.41 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 61.8 tp -120.66 139.36 53.13 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.921 0.391 . . . . 0.0 112.019 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 38.5 t -71.57 124.54 24.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.768 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -103.34 129.0 50.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.013 0.435 . . . . 0.0 111.294 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.4 m -115.88 65.91 0.7 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.256 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.867 HD13 ' H ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -71.76 43.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.574 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 61.91 21.75 12.52 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 122.978 0.511 . . . . 0.0 112.067 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -127.45 136.05 51.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.9 t80 -91.42 128.24 47.65 Favored Pre-proline 0 C--N 1.316 -0.853 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.087 179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 87.0 Cg_endo -97.71 178.26 7.54 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 124.134 -1.194 . . . . 0.0 112.708 -0.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 69.7 m -79.46 149.24 31.62 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -139.95 138.17 35.34 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.398 -0.521 . . . . 0.0 112.143 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.627 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 5.7 m -69.49 130.8 43.48 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -117.71 153.49 50.7 Favored Pre-proline 0 C--N 1.321 -0.667 0 O-C-N 123.799 0.687 . . . . 0.0 109.257 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.704 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 18.2 Cg_endo -63.18 154.58 66.73 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.335 2.023 . . . . 0.0 111.566 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -77.09 113.06 14.41 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.49 -27.53 2.36 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.643 178.895 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 23.9 p -160.96 159.7 29.85 Favored 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.212 0.32 . . . . 0.0 110.142 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 75.0 mt -80.68 126.31 31.12 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.699 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.528 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.34 -159.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.136 0.493 . . . . 0.0 112.104 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.649 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -70.8 128.12 34.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.269 0.557 . . . . 0.0 111.241 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.25 39.1 7.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.484 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -100.34 132.39 45.74 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.51 ' OD1' ' HB2' ' A' ' 30' ' ' PRO . 49.5 t0 -61.87 132.96 54.76 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.521 0.513 . . . . 0.0 110.671 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.0 m -92.98 153.65 18.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.169 0.509 . . . . 0.0 110.861 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 11.6 m -79.34 128.1 76.61 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.021 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 18.2 Cg_endo -60.87 -57.28 0.67 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.185 2.59 . . . . 0.0 113.832 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.446 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 16.0 m-90 -80.31 -52.55 7.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.935 0.398 . . . . 0.0 111.081 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.0 t -176.93 147.9 0.61 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.245 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.86 -141.61 6.29 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.121 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -65.6 142.39 58.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.365 0.602 . . . . 0.0 111.365 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.0 m -97.62 150.93 20.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.527 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.536 ' HA ' ' HB2' ' A' ' 3' ' ' LEU . 35.1 m -64.69 140.79 58.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.408 0.147 . . . . 0.0 111.121 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.2 m -65.83 145.74 55.59 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.2 ptmt -78.79 140.23 58.54 Favored Pre-proline 0 C--N 1.309 -1.153 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.956 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.545 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 95.8 Cg_endo -102.29 38.13 5.01 Favored 'Cis proline' 0 N--CA 1.455 -0.773 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.403 0.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.649 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 2.2 m-85 -70.73 145.69 50.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 110.097 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 tp -123.82 139.68 53.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.036 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 40.2 t -70.47 125.62 27.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.069 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.5 p -100.15 128.64 46.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.021 0.438 . . . . 0.0 111.286 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 45.8 m -120.09 69.0 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.79 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 15.6 pt -70.57 46.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 59.73 21.23 10.0 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.147 0.579 . . . . 0.0 112.132 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.428 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 64.9 m-85 -144.41 140.3 28.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.221 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.672 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 30.0 t80 -90.45 142.62 28.34 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.672 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 87.4 Cg_endo -94.59 157.97 16.51 Favored 'Cis proline' 0 N--CA 1.455 -0.74 0 C-N-CA 124.177 -1.176 . . . . 0.0 113.626 0.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 70.9 m -78.73 139.62 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.26 140.08 37.57 Favored 'General case' 0 C--N 1.32 -0.704 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.72 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.652 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 9.7 m -65.23 131.24 45.99 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.697 179.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.7 mmt85 -124.82 152.11 69.23 Favored Pre-proline 0 C--N 1.325 -0.472 0 O-C-N 124.0 0.813 . . . . 0.0 109.435 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 45.9 Cg_exo -55.07 143.73 72.5 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.789 2.326 . . . . 0.0 112.114 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 26.8 tptp -78.93 66.09 4.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.564 0.697 . . . . 0.0 110.253 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.6 45.22 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.419 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 7.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.601 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? . . . . . 0 N--CA 1.483 1.187 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p -162.36 161.63 27.5 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.505 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.47 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 90.8 mt -79.41 136.62 37.01 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.437 -179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.53 -169.06 1.55 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -71.56 134.17 46.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.846 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 58.26 40.77 24.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.481 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.71 145.73 30.71 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.986 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.2 p30 -65.15 151.69 45.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.99 0.424 . . . . 0.0 110.594 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.47 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 7.6 p -158.03 -176.04 5.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 110.783 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.7 m -157.87 146.44 14.35 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.352 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -50.32 -37.17 49.67 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.84 3.027 . . . . 0.0 113.587 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 15.4 m-90 -128.61 -50.05 1.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.924 0.392 . . . . 0.0 110.914 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 m -79.67 56.83 2.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.33 155.26 26.5 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.183 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -74.13 168.19 20.06 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.9 m -79.44 141.29 36.93 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.606 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 29.9 m -74.74 142.43 44.36 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -63.0 145.93 54.32 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -77.82 141.78 64.44 Favored Pre-proline 0 C--N 1.312 -1.038 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.599 -178.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.576 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 89.1 Cg_endo -102.68 39.02 4.46 Favored 'Cis proline' 0 N--CA 1.456 -0.718 0 C-N-CA 124.17 -1.179 . . . . 0.0 113.941 1.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 55.3 m-85 -77.13 146.06 37.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 0.0 110.744 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.3 tp -119.71 137.43 53.93 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.495 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 53.5 t -71.83 115.33 10.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.701 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.5 p -95.99 127.13 41.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.058 0.456 . . . . 0.0 110.964 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 95.4 m -116.52 69.92 0.76 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.444 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.4 pt -69.07 48.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 61.39 22.45 12.84 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.444 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 63.0 m-85 -140.48 131.37 26.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.008 0.433 . . . . 0.0 110.235 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.553 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 5.9 t80 -92.09 136.54 25.83 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.822 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.553 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 96.3 Cg_endo -88.19 170.39 35.06 Favored 'Cis proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.667 -1.389 . . . . 0.0 112.625 -0.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.2 m -78.91 178.5 7.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.6 p -156.27 128.38 7.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.299 -0.56 . . . . 0.0 112.282 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.5 m -69.4 124.42 23.83 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 31.9 mmt180 -118.58 158.8 46.23 Favored Pre-proline 0 C--N 1.324 -0.514 0 O-C-N 124.027 0.829 . . . . 0.0 109.714 -179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 19.4 Cg_endo -60.03 148.7 88.11 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.523 2.149 . . . . 0.0 112.138 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.576 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 27.5 ttpt -78.66 76.15 5.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.105 0.479 . . . . 0.0 110.216 -179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.35 40.43 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.141 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.517 ' HB2' ' HG2' ' A' ' 35' ' ' PRO . 53.3 t-105 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.475 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.8 ptpt . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 16' ' ' SER . 22.3 p -161.35 154.86 21.64 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 123.33 0.394 . . . . 0.0 109.997 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.422 HD13 ' O ' ' A' ' 8' ' ' ASP . 89.6 mt -82.5 132.05 35.21 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.2 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.69 -165.74 0.77 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.146 0.498 . . . . 0.0 111.633 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.507 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 5.8 pt-20 -76.31 138.52 40.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.297 0.57 . . . . 0.0 111.14 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 63.31 39.48 9.45 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.964 -178.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.405 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -109.82 138.74 45.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.011 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.422 ' O ' HD13 ' A' ' 3' ' ' LEU . 25.9 t70 -57.34 141.49 46.83 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.39 0.431 . . . . 0.0 110.488 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 17.0 p -156.27 -178.34 7.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.55 0.69 . . . . 0.0 111.94 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.1 m -154.82 145.9 16.5 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.094 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -50.71 -37.98 55.17 Favored 'Trans proline' 0 CA--C 1.53 0.324 0 C-N-CA 123.95 3.1 . . . . 0.0 113.86 -178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.9 m-90 -129.97 -51.01 1.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.867 0.365 . . . . 0.0 111.196 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.9 m -78.44 58.39 2.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.742 -179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -170.81 154.06 22.09 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.589 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -63.13 157.11 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.051 0.453 . . . . 0.0 110.858 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 2.3 m -79.09 141.46 37.32 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.297 -0.41 . . . . 0.0 109.98 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.2 m -76.29 144.68 40.12 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.353 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 58.4 m -63.93 148.72 48.85 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 21.4 ptmt -79.12 141.82 58.68 Favored Pre-proline 0 C--N 1.31 -1.118 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 88.0 Cg_endo -101.57 35.53 6.74 Favored 'Cis proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.995 -1.252 . . . . 0.0 113.599 0.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.848 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 25.6 m-85 -74.12 155.27 38.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.9 tp -134.15 138.69 45.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.866 0.365 . . . . 0.0 111.689 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 49.9 t -68.85 120.81 15.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.576 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.3 p -102.05 124.72 48.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.279 0.561 . . . . 0.0 111.682 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 61.6 m -119.54 56.54 0.93 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.601 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.408 HG12 ' H ' ' A' ' 26' ' ' ILE . 17.2 pt -71.49 46.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 61.28 19.02 9.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.944 0.498 . . . . 0.0 112.08 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -120.9 131.92 54.66 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 50.0 t80 -91.63 129.03 44.09 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.127 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.512 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.6 Cg_endo -97.28 178.71 7.63 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.16 -1.183 . . . . 0.0 112.453 -0.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 75.4 m -78.86 151.06 32.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.3 p -149.77 134.75 17.91 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 119.979 -0.689 . . . . 0.0 112.247 -179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.2 m -67.66 130.59 43.5 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -122.3 151.42 59.11 Favored Pre-proline 0 C--N 1.32 -0.684 0 O-C-N 124.175 0.922 . . . . 0.0 110.076 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.848 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 38.4 Cg_exo -57.65 146.46 84.77 Favored 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 122.393 2.062 . . . . 0.0 110.48 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 23.2 ttmt -77.73 124.96 28.62 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.275 -0.57 . . . . 0.0 109.947 -179.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.22 -29.35 2.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -178.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.504 ' CZ3' ' HB2' ' A' ' 35' ' ' PRO . 5.3 m-90 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.488 -0.767 . . . . 0.0 109.503 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.8 p -160.98 157.51 26.46 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' CYS . 80.2 mt -79.61 135.45 36.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.983 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -78.45 -166.82 0.92 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.174 0.511 . . . . 0.0 112.363 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.477 ' OE2' ' HB1' ' A' ' 4' ' ' ALA . 1.7 pm0 -73.78 132.36 42.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.058 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 61.73 38.37 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.544 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.85 141.46 36.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.566 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -64.93 148.85 50.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.111 0.481 . . . . 0.0 110.894 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.491 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 0.9 OUTLIER -142.53 149.32 38.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.469 0.652 . . . . 0.0 111.099 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.7 m -79.82 131.21 64.54 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.081 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' HG2' ' CE3' ' A' ' 12' ' ' TRP . 52.4 Cg_endo -67.37 -47.27 2.28 Favored 'Trans proline' 0 N--CA 1.473 0.31 0 C-N-CA 123.386 2.724 . . . . 0.0 113.962 -178.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.499 ' CE3' ' HG2' ' A' ' 11' ' ' PRO . 15.9 m-90 -79.34 -51.58 9.23 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.591 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 68.2 m -161.42 135.09 6.62 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.024 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -177.67 -160.7 24.72 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -70.16 146.25 50.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.009 0.433 . . . . 0.0 110.775 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -81.88 145.53 30.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.287 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 13.2 m -75.24 142.91 43.32 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.1 m -63.23 143.62 57.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 18.5 mtmt -78.14 144.45 67.22 Favored Pre-proline 0 C--N 1.313 -1.018 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.139 -178.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.585 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 93.8 Cg_endo -101.19 40.09 4.31 Favored 'Cis proline' 0 N--CA 1.451 -0.989 0 C-N-CA 123.473 -1.47 . . . . 0.0 113.706 1.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.677 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 7.8 m-85 -77.48 145.03 37.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.894 0.378 . . . . 0.0 110.435 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.7 tp -120.23 137.54 54.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.623 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 53.1 t -71.27 120.77 17.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.883 179.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.4 p -103.88 129.04 51.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.05 0.452 . . . . 0.0 111.037 -179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.6 m -114.84 66.98 0.69 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 17.6 pt -70.28 47.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 60.91 22.06 12.24 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -129.71 133.26 46.95 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 20.2 t80 -92.38 128.6 44.11 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.171 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 91.4 Cg_endo -93.32 -177.89 8.18 Favored 'Cis proline' 0 N--CA 1.451 -1.016 0 C-N-CA 123.713 -1.369 . . . . 0.0 112.197 -0.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.5 m -78.55 171.56 14.94 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.7 p -152.95 128.93 10.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 10.6 m -69.3 127.13 31.95 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -117.63 149.65 45.37 Favored Pre-proline 0 C--N 1.323 -0.583 0 O-C-N 124.038 0.836 . . . . 0.0 110.119 -179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.677 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.9 Cg_exo -57.93 144.53 93.99 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.898 2.399 . . . . 0.0 111.814 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 43.1 tttm -78.86 68.97 4.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.541 0.686 . . . . 0.0 110.474 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.67 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.767 -179.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.435 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 7.8 p90 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.462 -179.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.0 mttp . . . . . 0 N--CA 1.486 1.351 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.636 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.1 p -77.15 144.25 38.53 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 118.521 -1.272 . . . . 0.0 111.715 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 91.6 mt -79.61 130.1 35.07 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 113.62 -1.627 . . . . 0.0 111.065 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.36 -164.05 0.58 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.224 0.535 . . . . 0.0 112.203 -179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 8.3 pm0 -66.62 128.31 35.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.972 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.74 37.33 7.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.333 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -98.86 128.32 45.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.923 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -67.88 153.81 42.93 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.29 0.567 . . . . 0.0 111.902 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 4.0 p -151.55 -169.77 3.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.634 179.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 13' ' ' SER . 34.4 t -159.96 131.2 3.88 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.059 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 10' ' ' SER . 36.5 Cg_exo -64.4 -27.53 62.83 Favored 'Trans proline' 0 N--CA 1.471 0.151 0 C-N-CA 123.364 2.709 . . . . 0.0 112.309 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.449 ' CE3' ' HD2' ' A' ' 11' ' ' PRO . 30.2 m-90 -79.03 -24.05 43.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.521 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.574 ' O ' ' HB3' ' A' ' 10' ' ' SER . 9.8 t -176.99 125.57 0.15 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.482 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 168.18 150.23 6.49 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.867 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.89 161.86 25.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.908 0.385 . . . . 0.0 110.253 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.636 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 5.8 m -79.83 145.69 32.64 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.409 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.499 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 8.4 m -73.37 146.83 44.88 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.19 179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.411 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 63.3 m -63.02 140.59 58.89 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -77.99 141.78 63.67 Favored Pre-proline 0 C--N 1.312 -1.036 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.807 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -101.28 45.55 2.58 Favored 'Cis proline' 0 CA--C 1.538 0.712 0 C-N-CA 124.171 -1.179 . . . . 0.0 114.052 1.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CD1' ' HA ' ' A' ' 35' ' ' PRO . 4.7 m-30 -79.47 148.46 31.88 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -128.29 134.79 49.0 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.131 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 2.5 t -75.19 116.56 16.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.462 0.648 . . . . 0.0 109.95 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.4 p -84.86 123.25 30.25 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.472 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 91.3 m -112.69 64.82 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.055 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.453 ' O ' ' HD1' ' A' ' 28' ' ' PHE . 17.2 pt -70.93 47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 61.67 21.11 11.9 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.103 0.561 . . . . 0.0 112.417 178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HD1' ' O ' ' A' ' 26' ' ' ILE . 22.2 m-85 -133.46 132.69 41.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.042 0.448 . . . . 0.0 109.892 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.535 ' CD1' ' HA ' ' A' ' 30' ' ' PRO . 12.6 t80 -91.83 133.62 30.4 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.895 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.535 ' HA ' ' CD1' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.91 174.14 15.44 Favored 'Cis proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.936 -1.277 . . . . 0.0 112.677 -0.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 9' ' ' CYS . 57.3 m -79.1 164.24 24.45 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.6 p -147.46 124.61 11.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.96 -0.696 . . . . 0.0 112.678 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 8.3 m -65.48 124.59 22.7 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.832 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -111.01 149.31 40.26 Favored Pre-proline 0 C--N 1.318 -0.782 0 O-C-N 124.135 0.897 . . . . 0.0 108.849 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.592 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 27.5 Cg_endo -64.56 150.38 88.32 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.553 2.168 . . . . 0.0 110.408 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.49 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 27.3 tptt -78.64 145.24 34.76 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.258 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 142.36 -33.59 1.89 Allowed Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 107.949 -2.06 . . . . 0.0 107.949 -177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 . . . . . 0 C--O 1.26 1.619 0 CA-C-O 117.734 -1.127 . . . . 0.0 108.229 177.043 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.4 tttm . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 p -160.88 165.89 29.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.983 0.42 . . . . 0.0 110.513 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 81.2 mt -86.07 133.53 33.89 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.677 -178.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.533 ' HB1' ' OE2' ' A' ' 5' ' ' GLU . . . -79.53 -161.32 0.32 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.806 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.665 ' HB3' ' HE2' ' A' ' 21' ' ' TYR . 2.0 pm0 -73.87 130.08 39.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.247 0.546 . . . . 0.0 111.395 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 64.26 38.9 7.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.736 -179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.536 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . . . -101.17 137.32 39.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.959 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -61.32 142.95 56.52 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.903 0.382 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 3' ' ' LEU . 1.8 p -144.38 163.32 34.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.46 0.648 . . . . 0.0 111.503 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.437 ' HB3' ' C ' ' A' ' 13' ' ' SER . 35.4 t -152.6 142.49 14.94 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.076 -0.966 . . . . 0.0 108.858 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.19 -36.34 55.65 Favored 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 123.927 3.085 . . . . 0.0 113.5 -178.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -123.66 -49.65 1.88 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.043 0.449 . . . . 0.0 110.759 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.437 ' C ' ' HB3' ' A' ' 10' ' ' SER . 12.2 m -86.96 52.76 2.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.114 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.79 149.89 18.26 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.516 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.475 ' HB3' ' HG ' ' A' ' 3' ' ' LEU . 37.4 t0 -73.56 165.56 24.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -80.66 142.53 33.86 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 33.4 m -72.52 139.97 47.9 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.8 m -63.2 146.0 54.3 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 20' ' ' PRO . 0.1 OUTLIER -78.58 139.74 59.11 Favored Pre-proline 0 C--N 1.311 -1.07 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.636 -179.064 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 19' ' ' LYS . 86.8 Cg_endo -103.95 37.2 4.87 Favored 'Cis proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.844 -1.315 . . . . 0.0 113.686 1.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.665 ' HE2' ' HB3' ' A' ' 5' ' ' GLU . 4.9 m-85 -66.73 156.56 35.04 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.829 0.347 . . . . 0.0 110.397 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.4 tp -130.79 134.96 47.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.785 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 47.6 t -70.06 120.57 15.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.767 -0.652 . . . . 0.0 109.674 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.3 p -101.4 121.08 41.27 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.099 0.476 . . . . 0.0 111.666 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 89.3 m -112.12 62.57 0.62 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 26' ' ' ILE . 10.0 tp -74.25 54.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 122.285 1.04 . . . . 0.0 112.445 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 55.95 23.46 6.67 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.373 -1.285 . . . . 0.0 112.897 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -128.77 133.62 48.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.019 0.438 . . . . 0.0 110.172 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 41.6 t80 -92.03 128.27 46.21 Favored Pre-proline 0 C--N 1.315 -0.92 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 83.3 Cg_endo -95.69 179.61 8.22 Favored 'Cis proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.981 -1.258 . . . . 0.0 112.212 -0.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.82 162.04 26.37 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -147.67 129.87 15.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.431 -0.508 . . . . 0.0 112.263 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 11.5 m -69.0 127.53 33.47 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.555 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 36.4 mtt180 -116.85 160.19 37.75 Favored Pre-proline 0 C--N 1.322 -0.613 0 O-C-N 123.768 0.667 . . . . 0.0 110.013 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.555 ' HD2' ' HB3' ' A' ' 34' ' ' ARG . 19.6 Cg_endo -62.95 150.55 88.2 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.284 1.99 . . . . 0.0 111.352 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.1 tptm -79.31 128.09 32.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.936 0.398 . . . . 0.0 110.481 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 141.21 50.21 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -178.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 m0 . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.759 -179.465 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.9 pttm . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' SER . 31.2 p -134.01 153.42 51.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.271 0.558 . . . . 0.0 111.066 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 8' ' ' ASP . 90.5 mt -88.57 140.27 29.63 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.621 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.24 -177.07 4.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.052 0.453 . . . . 0.0 111.752 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 10.4 pt-20 -71.8 140.01 49.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.031 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 42.43 17.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.661 -178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -119.34 145.26 46.32 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.712 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.459 ' O ' HD13 ' A' ' 3' ' ' LEU . 3.3 p30 -61.67 149.95 38.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.919 0.39 . . . . 0.0 110.947 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.37 153.08 39.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.787 0.803 . . . . 0.0 111.995 -179.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 31.6 t -108.41 138.72 20.28 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 114.532 -1.213 . . . . 0.0 108.884 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.55 -34.11 88.77 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.197 2.598 . . . . 0.0 113.384 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -140.15 -50.26 0.47 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.952 0.406 . . . . 0.0 111.473 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 m -78.04 58.57 2.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.873 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -174.96 156.53 22.78 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.441 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.5 149.77 28.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.607 ' O ' ' HA ' ' A' ' 2' ' ' CYS . 3.6 m -79.02 145.85 33.65 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 23' ' ' CYS . 14.6 m -65.13 144.04 57.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.544 0.211 . . . . 0.0 111.121 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.2 m -64.01 141.51 58.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -79.49 149.11 71.33 Favored Pre-proline 0 C--N 1.31 -1.117 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.936 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 97.5 Cg_endo -96.71 34.4 8.89 Favored 'Cis proline' 0 N--CA 1.449 -1.095 0 C-N-CA 122.805 -1.748 . . . . 0.0 113.829 1.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.833 ' HD1' ' HA ' ' A' ' 35' ' ' PRO . 34.0 m-85 -77.94 145.17 36.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.872 0.367 . . . . 0.0 110.358 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.7 tp -121.17 141.45 50.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.713 -178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 46.8 t -71.36 122.45 20.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.675 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -105.96 127.87 53.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 111.25 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.7 m -114.32 64.76 0.66 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 26' ' ' ILE . 9.9 tp -73.28 55.01 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 122.356 1.074 . . . . 0.0 112.484 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 56.11 23.67 7.15 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.366 -1.288 . . . . 0.0 112.992 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -127.91 132.95 49.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.991 0.424 . . . . 0.0 110.111 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 30' ' ' PRO . 37.8 t80 -92.45 127.25 49.34 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.17 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HA ' ' HA ' ' A' ' 29' ' ' TYR . 88.8 Cg_endo -93.65 -177.7 7.81 Favored 'Cis proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.82 -1.325 . . . . 0.0 112.212 -0.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.2 m -78.15 165.18 24.27 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -149.51 131.97 15.7 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.487 -0.485 . . . . 0.0 112.037 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 4.3 m -70.18 132.37 45.68 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.506 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 30.1 mmt180 -126.74 160.63 57.71 Favored Pre-proline 0 C--N 1.322 -0.623 0 O-C-N 124.171 0.919 . . . . 0.0 109.016 -179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.833 ' HA ' ' HD1' ' A' ' 21' ' ' TYR . 18.8 Cg_endo -59.24 153.55 52.32 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.341 2.027 . . . . 0.0 111.17 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 20' ' ' PRO . 88.1 tttt -77.3 116.46 17.93 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.818 -179.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.79 45.74 1.88 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.128 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.461 ' HE3' ' O ' ' A' ' 35' ' ' PRO . 5.5 p90 . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.129 -0.938 . . . . 0.0 110.382 -179.858 . . . . . . . . 1 1 . 1 stop_ save_