data_1uwo_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 1uwo _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' B' ' 38' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.459 ' HG3' ' HB3' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -71.88 -59.92 2.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.446 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -72.31 -23.96 61.25 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.455 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.417 ' HB3' ' N ' ' A' ' 1' ' ' SER . 10.6 tm-20 -62.77 -61.25 2.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -41.9 94.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.226 -0.921 . . . . 0.0 109.326 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.509 ' O ' ' CD1' ' A' ' 10' ' ' LEU . . . -66.91 -19.07 65.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.264 -0.898 . . . . 0.0 109.42 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.521 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 2.2 mtp -76.32 -44.13 38.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.401 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -65.94 -38.18 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.501 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -75.04 -65.67 0.85 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.481 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.526 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 0.5 OUTLIER -43.76 -41.24 4.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.448 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.521 ' CG1' ' O ' ' A' ' 7' ' ' MET . 61.9 mt -62.19 -45.23 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -56.99 -27.37 61.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.227 -0.921 . . . . 0.0 109.357 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.581 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -80.01 -28.7 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.266 -0.897 . . . . 0.0 109.068 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 34.4 t80 -66.33 -45.69 79.4 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.055 -1.028 . . . . 0.0 109.45 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.465 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 8.1 m-70 -80.32 -34.55 36.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.597 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.14 -63.38 1.26 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.494 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.449 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 43.8 m-85 -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.522 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 82.9 p -61.18 -21.09 63.48 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.288 -0.883 . . . . 0.0 109.486 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -66.73 -31.99 80.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.3 mmt180 -52.51 -41.56 63.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -1.132 . . . . 0.0 109.477 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 23' ' ' ASP . 43.6 tt0 -76.6 81.89 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.451 ' O ' ' O ' ' A' ' 23' ' ' ASP . . . 43.63 -95.23 0.01 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -57.91 -158.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -1.133 . . . . 0.0 109.448 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.8 pttp -153.93 89.79 1.33 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 109.412 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.564 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -169.05 -36.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.522 ' N ' ' HB2' ' A' ' 18' ' ' SER . 0.0 OUTLIER -122.74 170.11 10.39 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 109.557 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.527 HD21 ' N ' ' A' ' 32' ' ' LEU . 2.9 mp -110.4 143.65 40.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.274 -0.891 . . . . 0.0 109.503 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 30' ' ' SER . 1.5 tttp -98.56 84.64 3.2 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.301 -0.875 . . . . 0.0 109.282 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.507 ' HG2' ' N ' ' A' ' 30' ' ' SER . 29.1 ttmt 43.17 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.425 -0.797 . . . . 0.0 110.847 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' A' ' 28' ' ' LYS . 2.0 t -47.61 -31.89 4.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.156 -0.965 . . . . 0.0 110.06 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -58.85 -45.62 89.63 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.832 -1.168 . . . . 0.0 108.64 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.527 ' N ' HD21 ' A' ' 27' ' ' LEU . 27.1 mt -58.65 -54.95 41.25 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.461 ' HA ' HD13 ' A' ' 36' ' ' ILE . 1.2 tttt -46.31 -42.46 14.69 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.386 -0.821 . . . . 0.0 109.391 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -58.47 7.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.23 -40.25 58.4 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.335 -0.853 . . . . 0.0 109.663 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.578 ' CG2' ' CD1' ' A' ' 47' ' ' ILE . 48.0 mt -61.75 -36.33 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.203 -0.936 . . . . 0.0 109.951 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLU . 6.8 m120 -94.92 -71.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.085 -1.01 . . . . 0.0 109.779 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 37' ' ' ASN . 2.6 t-20 -41.53 -27.08 0.08 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.421 -0.799 . . . . 0.0 110.111 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' CD2' ' A' ' 35' ' ' LEU . 1.6 mm-40 -112.03 -46.14 3.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.09 -1.006 . . . . 0.0 109.726 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.463 ' O ' ' O ' ' A' ' 36' ' ' ILE . 9.3 mp -106.9 61.97 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.103 -0.998 . . . . 0.0 109.582 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.218 -0.926 . . . . 0.0 109.409 179.886 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.578 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 1.1 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.568 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 12.5 mttt 83.59 -44.58 0.11 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.553 -0.717 . . . . 0.0 109.367 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 60.9 mm-40 -110.32 14.69 22.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.238 -0.914 . . . . 0.0 109.03 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.536 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.4 mt-30 78.34 59.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.711 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 3.7 mp0 -90.08 -70.6 0.66 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.215 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.525 ' CG1' HG11 ' A' ' 80' ' ' VAL . 1.3 t -91.44 -21.18 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.126 -0.984 . . . . 0.0 108.629 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.515 ' CG2' HD11 ' A' ' 36' ' ' ILE . 55.2 t -73.22 -30.73 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.368 -0.832 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.46 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -90.09 -40.42 12.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.405 -0.809 . . . . 0.0 109.113 179.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -64.41 -35.5 81.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.326 -0.859 . . . . 0.0 109.272 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.509 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 4.4 m -55.38 -56.54 11.17 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.263 -0.898 . . . . 0.0 109.716 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.455 ' C ' ' O ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -41.49 -28.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.001 -1.062 . . . . 0.0 109.626 -179.768 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.1 tp10 -69.59 -55.99 8.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.285 -0.884 . . . . 0.0 108.788 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.468 ' O ' ' C ' ' A' ' 60' ' ' LEU . 9.6 m -81.28 -61.68 1.88 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 108.877 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.528 ' CD2' ' HB2' ' A' ' 76' ' ' PHE . 6.5 mp -37.82 -36.43 0.19 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.695 -0.628 . . . . 0.0 109.79 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 57' ' ' MET . 28.0 t0 -89.98 95.73 10.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.213 -0.93 . . . . 0.0 109.433 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -109.69 11.23 24.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.248 -0.908 . . . . 0.0 109.498 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -120.97 -30.21 4.44 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.518 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.33 90.77 0.56 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.87 -32.47 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.271 -1.135 . . . . 0.0 108.618 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.2 31.15 Favored Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 21.9 mt-10 -88.25 107.12 18.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -1.166 . . . . 0.0 109.402 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CD1' ' A' ' 32' ' ' LEU . 4.3 m -69.82 143.58 52.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.256 -0.902 . . . . 0.0 109.797 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.0 m-20 -116.62 169.5 9.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.487 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -51.0 -47.48 61.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.233 -0.917 . . . . 0.0 110.072 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.462 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 16.6 mt-30 -47.92 -42.09 26.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.44 -0.787 . . . . 0.0 109.582 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -79.03 -25.02 43.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.163 -0.961 . . . . 0.0 109.979 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 10.4 t80 -59.3 -58.32 9.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.069 -1.019 . . . . 0.0 109.407 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.554 ' CB ' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -68.36 -49.73 58.15 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.233 -0.917 . . . . 0.0 109.46 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.96 -23.47 19.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.117 -0.99 . . . . 0.0 108.973 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.577 ' CE1' HG22 ' A' ' 80' ' ' VAL . 2.2 t80 -70.3 -63.67 1.04 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.509 ' O ' ' CB ' ' A' ' 81' ' ' THR . 3.3 t -52.91 -23.57 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.55 ' CB ' ' CB ' ' B' ' 74' ' ' MET . . . -62.33 -54.23 43.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.421 -0.799 . . . . 0.0 108.865 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 83' ' ' ALA . 1.4 mmm -70.52 -69.44 0.36 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.379 -0.825 . . . . 0.0 109.479 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.577 HG22 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.03 -25.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 120.567 -1.333 . . . . 0.0 110.129 -179.416 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.515 ' N ' ' O ' ' A' ' 79' ' ' MET . 3.2 m -76.36 -69.98 0.47 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.919 -1.113 . . . . 0.0 108.512 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.572 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.6 t -78.04 -49.91 13.09 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.572 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.95 -47.75 1.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.2 t -61.27 -47.12 87.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.471 -0.768 . . . . 0.0 109.286 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -9.93 51.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.25 -0.906 . . . . 0.0 109.488 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 87' ' ' PHE . 0.8 OUTLIER -82.68 -21.06 35.05 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.313 -0.867 . . . . 0.0 109.498 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 O-C-N 121.25 -0.906 . . . . 0.0 109.486 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.51 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.467 ' HB3' HD23 ' B' ' 3' ' ' LEU . 1.3 tp10 -70.38 -55.35 9.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.526 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 3.1 mm? -75.44 -27.64 59.02 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 0.0 109.39 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.51 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 2.8 tm-20 -67.15 -61.55 1.87 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.82 -49.3 71.37 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.92 . . . . 0.0 109.41 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.517 ' HB2' ' CD1' ' A' ' 10' ' ' LEU . . . -65.02 -22.59 67.02 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.289 -0.882 . . . . 0.0 109.453 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.49 ' CG ' HD13 ' B' ' 11' ' ' ILE . 5.3 ttt -68.95 -42.61 76.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.427 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.8 t -70.34 -34.16 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.217 -0.927 . . . . 0.0 109.433 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.459 ' HB3' ' HG3' ' A' ' 2' ' ' GLU . . . -65.73 -64.46 0.86 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.243 -0.911 . . . . 0.0 109.472 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.505 ' HB3' ' CE2' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -50.74 -47.94 59.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.473 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.49 HD13 ' CG ' ' B' ' 7' ' ' MET . 88.7 mt -56.42 -36.0 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.179 -0.951 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.7 OUTLIER -67.6 -29.85 69.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.244 -0.91 . . . . 0.0 109.439 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.577 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 10.8 t -75.72 -25.02 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.4 t80 -74.69 -50.95 15.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.996 -1.065 . . . . 0.0 109.478 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m80 -78.28 -20.82 50.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.25 -0.906 . . . . 0.0 109.832 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 53.3 tt0 -83.13 -60.29 2.2 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.139 -0.976 . . . . 0.0 109.565 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.609 ' CD2' ' CD1' ' B' ' 35' ' ' LEU . 28.0 m-85 -63.32 -28.18 69.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.889 . . . . 0.0 109.541 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.513 ' HB2' ' N ' ' B' ' 25' ' ' HIS . 84.6 p -71.09 -20.48 62.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.189 -0.945 . . . . 0.0 109.69 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.96 30.28 10.71 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.515 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.14 -59.49 2.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -1.144 . . . . 0.0 109.529 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 22' ' ' GLY . 0.2 OUTLIER -114.74 97.54 6.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.9 . . . . 0.0 109.513 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 49.78 -179.85 0.02 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' B' ' 22' ' ' GLY . 81.0 m-20 52.06 174.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -1.162 . . . . 0.0 109.452 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -172.44 59.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.24 -0.912 . . . . 0.0 109.511 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.513 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -169.2 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.275 -0.891 . . . . 0.0 109.542 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.471 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 1.4 mptt -122.97 160.75 25.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 109.54 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.519 ' CB ' ' HB2' ' B' ' 31' ' ' GLU . 3.8 mp -109.27 132.29 54.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.928 . . . . 0.0 109.584 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -79.73 170.12 16.98 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -45.82 -25.01 0.45 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.879 -1.138 . . . . 0.0 109.324 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.496 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 0.2 OUTLIER -82.28 -50.54 8.84 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.646 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.519 ' HB2' ' CB ' ' B' ' 27' ' ' LEU . 43.0 mt-10 -56.68 -38.65 72.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.13 . . . . 0.0 109.402 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.521 ' CD1' ' HE1' ' B' ' 57' ' ' MET . 16.0 mt -65.02 -57.44 8.68 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.594 -0.691 . . . . 0.0 109.293 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.571 ' CD ' ' CG1' ' B' ' 53' ' ' VAL . 0.1 OUTLIER -42.27 -50.29 4.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.339 -0.851 . . . . 0.0 109.497 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -51.58 -61.62 2.13 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.188 -0.945 . . . . 0.0 109.151 179.736 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.609 ' CD1' ' CD2' ' B' ' 17' ' ' TYR . 1.1 tp -43.47 -38.1 2.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.311 -0.868 . . . . 0.0 109.43 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.627 ' CD1' ' CZ ' ' B' ' 76' ' ' PHE . 3.0 mm -57.18 -49.93 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.229 -0.919 . . . . 0.0 109.586 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' B' ' 39' ' ' GLU . 51.1 m-80 -93.01 -65.35 1.0 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 109.807 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.454 ' O ' ' OG ' ' A' ' 1' ' ' SER . 0.6 OUTLIER -41.14 -26.92 0.06 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.412 -0.805 . . . . 0.0 110.265 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' B' ' 35' ' ' LEU . 3.9 mm-40 -118.73 -40.54 2.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.987 -1.071 . . . . 0.0 109.986 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 5.3 mp -108.14 67.11 0.66 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.094 -1.004 . . . . 0.0 109.596 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 28.1 t . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 109.417 179.879 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.52 ' CD1' HG23 ' B' ' 36' ' ' ILE . 10.5 mm . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.1 mmtp -111.28 55.33 0.66 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.501 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 3.0 tp10 74.31 41.79 0.36 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.261 -0.9 . . . . 0.0 109.353 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 72.51 51.48 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.304 -0.872 . . . . 0.0 109.447 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.458 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 24.7 tt0 -88.65 -70.16 0.66 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.492 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.528 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.4 t -87.47 -21.21 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.349 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.571 ' CG1' ' CD ' ' B' ' 33' ' ' LYS . 77.0 t -73.54 -26.06 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.207 -0.933 . . . . 0.0 109.27 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -85.16 -47.95 9.62 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 109.438 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 14.0 mttt -62.58 -41.9 99.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.213 -0.929 . . . . 0.0 109.395 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 31.1 m -59.28 -49.34 83.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 O-C-N 121.196 -0.94 . . . . 0.0 109.474 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.521 ' HE1' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -44.5 -26.38 0.35 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.977 -1.077 . . . . 0.0 109.453 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' B' ' 55' ' ' LYS . 0.8 OUTLIER -77.08 -45.79 25.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.224 -0.922 . . . . 0.0 108.994 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.443 ' O ' ' C ' ' B' ' 60' ' ' LEU . 66.5 m -84.31 -63.81 1.27 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.312 -0.867 . . . . 0.0 109.371 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.539 ' CG ' ' HB2' ' B' ' 76' ' ' PHE . 9.1 mp -41.73 -27.86 0.12 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.585 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' B' ' 57' ' ' MET . 3.6 m-20 -63.55 114.68 4.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.256 -0.903 . . . . 0.0 109.333 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' B' ' 67' ' ' GLU . 2.6 t-20 -42.77 -44.31 4.34 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.386 -0.821 . . . . 0.0 109.623 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.73 28.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.245 -0.909 . . . . 0.0 109.566 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.3 90.87 1.18 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' B' ' 65' ' ' ASP . 43.5 t0 -179.34 -34.44 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.11 . . . . 0.0 108.581 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.12 38.65 1.64 Allowed Glycine 0 N--CA 1.485 1.912 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' B' ' 62' ' ' ASN . 15.2 pt-20 -141.09 105.74 4.9 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.205 -1.174 . . . . 0.0 109.469 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.471 ' N ' ' HB3' ' B' ' 26' ' ' LYS . 12.2 t -78.59 153.4 31.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.256 -0.902 . . . . 0.0 109.748 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.464 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -110.13 171.16 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -61.27 -48.95 79.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.155 -0.965 . . . . 0.0 109.973 -179.804 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.455 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 9.4 mp0 -54.84 -40.19 69.35 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 108.953 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.464 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 1.2 mt-10 -78.83 -18.47 53.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.407 -0.808 . . . . 0.0 109.527 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.505 ' CE2' ' HB3' ' B' ' 10' ' ' LEU . 3.5 t80 -67.25 -62.14 1.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.181 -0.949 . . . . 0.0 109.046 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.55 ' CB ' ' CB ' ' A' ' 78' ' ' ALA . 1.8 tpp -63.51 -48.04 79.23 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.108 -0.995 . . . . 0.0 108.978 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.454 ' O ' ' HB1' ' B' ' 78' ' ' ALA . . . -51.54 -36.47 45.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.161 -0.962 . . . . 0.0 108.622 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.627 ' CZ ' ' CD1' ' B' ' 36' ' ' ILE . 0.2 OUTLIER -57.86 -62.95 1.44 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.235 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.599 ' N ' ' CD2' ' B' ' 76' ' ' PHE . 3.5 t -49.74 -27.9 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.554 ' CB ' ' CB ' ' A' ' 74' ' ' MET . . . -58.4 -54.56 45.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.387 -0.821 . . . . 0.0 109.093 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' N ' ' B' ' 83' ' ' ALA . 54.7 mtm -71.47 -68.84 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.365 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.588 HG22 ' CZ ' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -40.6 -26.48 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 120.602 -1.311 . . . . 0.0 110.036 -179.637 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.517 ' N ' ' O ' ' B' ' 79' ' ' MET . 3.7 m -75.11 -70.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.993 -1.067 . . . . 0.0 108.7 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.7 t -78.08 -49.63 13.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.124 -0.985 . . . . 0.0 108.455 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.577 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.78 -44.22 0.72 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.752 -0.592 . . . . 0.0 109.71 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.37 -28.86 19.5 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.571 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' B' ' 81' ' ' THR . 0.8 OUTLIER -65.54 -70.06 0.26 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' B' ' 85' ' ' HIS . 0.0 OUTLIER -43.95 -28.32 0.45 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.505 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . 0.404 ' C ' ' O ' ' B' ' 86' ' ' GLU . 11.2 t80 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.202 -0.936 . . . . 0.0 109.417 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.515 ' HB2' ' CB ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.522 ' HG3' ' CB ' ' B' ' 9' ' ' ALA . 0.5 OUTLIER -68.28 -79.45 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.525 HD12 ' CD2' ' B' ' 35' ' ' LEU . 4.9 mp -68.13 -23.04 64.85 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.164 -0.96 . . . . 0.0 109.421 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.515 ' CB ' ' HB2' ' A' ' 1' ' ' SER . 0.2 OUTLIER -63.3 -60.84 2.86 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.23 -0.918 . . . . 0.0 109.229 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.1 tttt -60.73 -29.58 69.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.342 -0.848 . . . . 0.0 109.182 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' CB ' ' HB3' ' B' ' 6' ' ' ALA . . . -71.42 -26.72 62.87 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.34 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.457 ' O ' HG13 ' A' ' 11' ' ' ILE . 1.9 ttm -75.62 -38.71 58.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.332 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.84 -39.49 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.313 -0.867 . . . . 0.0 109.433 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' HB3' ' B' ' 2' ' ' GLU . . . -72.85 -62.93 1.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 109.508 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.524 HD21 ' CZ ' ' A' ' 73' ' ' PHE . 48.7 mt -44.12 -43.69 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.385 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 7' ' ' MET . 62.3 mt -56.75 -53.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.5 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -54.51 -22.78 13.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.578 ' CG1' ' CD1' ' A' ' 35' ' ' LEU . 4.2 t -82.58 -33.7 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.29 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.547 ' CZ ' ' N ' ' A' ' 70' ' ' PHE . 9.9 t80 -63.12 -47.46 82.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.055 -1.028 . . . . 0.0 109.523 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -80.72 -46.33 15.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 109.712 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -54.52 -62.45 1.65 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 109.669 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.576 ' CD2' ' HG ' ' A' ' 35' ' ' LEU . 30.2 m-85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.657 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 26.2 m -60.16 -21.43 61.65 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.158 -0.964 . . . . 0.0 109.617 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.66 30.28 10.75 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.504 ' CG ' ' HA ' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.01 -50.78 5.82 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -1.17 . . . . 0.0 109.511 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . 81.3 mt-10 -134.72 83.99 2.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.258 -0.901 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.82 -170.81 54.94 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' HD2' ' A' ' 24' ' ' LYS . 88.7 m-20 47.75 -169.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.313 -1.11 . . . . 0.0 109.502 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.418 ' C ' ' HB3' ' A' ' 18' ' ' SER . 0.3 OUTLIER -169.31 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.491 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -108.08 16.15 23.61 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.251 -0.906 . . . . 0.0 109.44 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -151.14 170.14 20.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.209 -0.932 . . . . 0.0 109.452 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.547 ' CG ' ' HB3' ' A' ' 31' ' ' GLU . 3.0 mp -108.46 141.22 40.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.88 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.607 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.8 OUTLIER -91.15 79.19 5.77 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 109.079 179.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.586 ' CG ' ' CG ' ' A' ' 57' ' ' MET . 0.0 OUTLIER 41.53 -83.03 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.578 -0.701 . . . . 0.0 111.17 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.607 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -49.24 -27.43 3.73 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.669 -1.269 . . . . 0.0 109.711 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HB3' ' CG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -60.31 -46.19 90.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.916 -1.115 . . . . 0.0 108.617 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.528 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 7.0 mt -59.75 -51.76 68.39 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HG3' ' CG1' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -46.36 -36.53 6.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 109.338 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -53.49 43.89 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.592 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.58 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 4.7 mt -50.72 -52.52 39.63 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.713 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.598 ' CD1' ' CE2' ' A' ' 76' ' ' PHE . 1.9 mp -66.51 -24.59 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.262 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -90.98 -3.72 57.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.222 -0.924 . . . . 0.0 109.615 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -114.05 -14.42 12.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.239 -0.913 . . . . 0.0 109.496 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.527 ' CG ' ' HG ' ' A' ' 40' ' ' LEU . 5.9 pt-20 -120.94 -14.93 8.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.483 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.527 ' HG ' ' CG ' ' A' ' 39' ' ' GLU . 23.8 mt -120.2 75.12 1.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.477 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.539 ' O ' ' CG ' ' A' ' 48' ' ' LYS . 43.4 mt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 7.4 pttm 40.24 28.48 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.636 -0.665 . . . . 0.0 109.877 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 5.8 tt0 170.56 -78.83 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -0.873 . . . . 0.0 109.3 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 14.1 pt20 -168.04 26.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.874 . . . . 0.0 109.518 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.25 -69.28 0.3 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.234 -0.916 . . . . 0.0 109.413 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.537 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 1.6 t -86.67 -21.13 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 109.342 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.528 HG22 ' CD1' ' A' ' 47' ' ' ILE . 41.3 t -77.02 -19.29 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.286 -0.884 . . . . 0.0 109.762 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 53.9 t0 -90.06 -36.5 14.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.181 -0.949 . . . . 0.0 109.598 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -79.74 -38.01 34.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.544 HG23 ' CZ ' ' A' ' 76' ' ' PHE . 30.8 m -60.43 -43.74 94.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.193 -0.942 . . . . 0.0 109.773 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.586 ' CG ' ' CG ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -39.78 -29.08 0.05 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.078 -1.014 . . . . 0.0 109.488 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.495 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -87.04 -42.56 12.99 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.811 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.539 ' CG2' ' CE ' ' A' ' 79' ' ' MET . 98.9 m -70.03 -64.92 0.8 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.79 . . . . 0.0 109.587 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.64 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 7.3 mt -38.4 -60.43 0.79 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.474 -0.766 . . . . 0.0 109.589 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.41 112.26 6.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.271 -0.893 . . . . 0.0 109.534 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -120.02 16.67 12.5 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.415 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.24 -47.87 2.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 92.17 2.18 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.89 -35.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -1.126 . . . . 0.0 108.567 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.12 22.83 6.66 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HB2' ' HG3' ' A' ' 26' ' ' LYS . 19.5 pt-20 -128.44 118.54 23.28 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -1.119 . . . . 0.0 109.437 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.82 132.51 46.17 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.25 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' OD1' ' CG ' ' A' ' 71' ' ' GLN . 1.2 p30 -104.59 169.62 8.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.301 -0.874 . . . . 0.0 108.97 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.547 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.19 -47.99 54.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.059 -1.026 . . . . 0.0 110.105 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 75' ' ' ALA . 14.1 pt20 -52.48 -37.5 57.35 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.672 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.524 ' OE2' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -82.38 -20.5 37.04 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.065 -1.022 . . . . 0.0 109.775 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.524 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 1.6 t80 -66.66 -64.27 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.133 -0.979 . . . . 0.0 109.061 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.529 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.9 -32.82 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.384 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' A' ' 71' ' ' GLN . . . -65.33 -31.71 72.98 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.263 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.64 ' CD2' ' CD1' ' A' ' 60' ' ' LEU . 1.1 t80 -70.44 -59.22 2.98 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.293 -0.879 . . . . 0.0 108.976 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.463 ' O ' ' OG1' ' A' ' 81' ' ' THR . 41.4 t -56.57 -25.39 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.54 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -64.67 -49.2 71.9 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.383 -0.823 . . . . 0.0 109.369 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 83' ' ' ALA . 2.3 mtm -71.94 -70.76 0.31 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.333 -0.855 . . . . 0.0 109.682 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.596 HG23 ' CD1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.91 -25.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 O-C-N 120.623 -1.298 . . . . 0.0 110.242 -179.187 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.482 ' N ' ' O ' ' A' ' 79' ' ' MET . 3.8 m -74.91 -68.03 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.875 -1.141 . . . . 0.0 108.589 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.588 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.8 m -81.68 -51.48 8.15 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -37.07 -40.64 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.206 0.527 . . . . 0.0 109.913 179.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.02 -40.89 30.22 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.605 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.2 OUTLIER -64.98 -11.89 43.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.139 -0.975 . . . . 0.0 109.477 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.45 ' OE2' HG21 ' A' ' 82' ' ' THR . 0.5 OUTLIER -90.31 -36.0 14.93 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.42 ' C ' ' O ' ' A' ' 86' ' ' GLU . 2.9 m-85 . . . . . 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 0.0 109.535 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.526 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 6.4 mm-40 -71.22 -63.47 1.1 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.248 -0.907 . . . . 0.0 109.386 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.58 ' CD1' ' CD2' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.18 -25.32 63.38 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.43 -65.6 0.67 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.317 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.413 ' HA ' HG13 ' B' ' 8' ' ' VAL . 0.1 OUTLIER -62.97 -37.06 85.58 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.273 -0.892 . . . . 0.0 109.25 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.519 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . . . -68.71 -17.23 64.03 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.411 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.25 -39.86 20.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.503 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.471 ' O ' HG21 ' B' ' 11' ' ' ILE . 2.4 p -68.97 -31.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.17 -0.956 . . . . 0.0 109.449 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.522 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -83.3 -50.42 8.4 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 3' ' ' LEU . 5.4 mt -57.75 -34.71 69.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.578 HG12 ' CZ ' ' B' ' 70' ' ' PHE . 0.0 OUTLIER -73.26 -47.61 46.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.15 -0.969 . . . . 0.0 109.402 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.543 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 65.8 t0 -57.34 -19.96 25.83 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.124 -0.985 . . . . 0.0 108.894 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.557 HG21 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -88.14 -41.94 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.37 -0.831 . . . . 0.0 109.632 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.473 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 34.2 t80 -53.93 -42.89 69.3 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.887 -1.133 . . . . 0.0 109.041 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.417 ' O ' ' C ' ' B' ' 16' ' ' GLN . 8.3 t-160 -77.58 -38.65 47.88 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.346 -0.846 . . . . 0.0 109.281 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' B' ' 15' ' ' HIS . 0.9 OUTLIER -44.03 -48.61 8.83 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 108.958 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.585 ' CE2' ' HG ' ' B' ' 35' ' ' LEU . 12.7 m-85 -92.47 -70.27 0.7 Allowed 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.403 -0.811 . . . . 0.0 109.107 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 4.1 p 38.87 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.594 -0.691 . . . . 0.0 109.99 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 88.12 44.19 5.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.428 ' C ' ' O ' ' B' ' 19' ' ' GLY . 0.1 OUTLIER -42.49 -27.42 0.16 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -1.042 . . . . 0.0 109.625 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.449 ' O ' ' HE2' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -100.05 69.91 1.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.03 -115.51 2.34 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' B' ' 19' ' ' GLY . 70.6 m-20 -61.85 148.61 42.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -1.17 . . . . 0.0 109.551 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.9 tttt -119.29 34.6 5.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.258 -0.901 . . . . 0.0 109.512 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.52 ' HB2' ' CE ' ' B' ' 26' ' ' LYS . 33.9 m170 -136.98 8.84 3.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.52 ' CE ' ' HB2' ' B' ' 25' ' ' HIS . 0.3 OUTLIER -169.95 156.24 6.03 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.537 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 9.8 mt -85.08 147.5 26.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -125.63 85.75 2.44 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.839 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' B' ' 30' ' ' SER . 12.6 tppt? 60.97 -86.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.361 -0.837 . . . . 0.0 110.211 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.518 ' N ' ' HG3' ' B' ' 29' ' ' LYS . 7.2 m -44.04 -52.49 7.07 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.172 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -55.91 -38.42 70.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.12 -0.987 . . . . 0.0 109.469 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.506 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 36.7 mt -61.25 -70.17 0.2 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.579 -0.701 . . . . 0.0 109.291 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.1 OUTLIER -44.85 -24.61 0.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.687 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.446 ' OE1' ' O ' ' B' ' 30' ' ' SER . 0.1 OUTLIER -71.52 -69.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.134 -0.979 . . . . 0.0 109.537 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.585 ' HG ' ' CE2' ' B' ' 17' ' ' TYR . 2.4 mt -43.99 -47.91 8.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.305 -0.872 . . . . 0.0 109.732 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.577 ' CG2' ' CD1' ' B' ' 47' ' ' ILE . 11.6 mm -60.93 -43.07 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.656 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.457 ' HA ' ' HB3' ' B' ' 41' ' ' SER . 13.5 m-80 -90.18 8.38 33.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' B' ' 34' ' ' GLU . 2.1 t30 -94.0 -46.25 7.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.199 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.511 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 3.8 mp0 -124.64 -9.9 7.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.896 . . . . 0.0 109.601 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.449 HD22 ' OG1' ' B' ' 81' ' ' THR . 5.2 mp -112.93 37.38 3.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.203 -0.935 . . . . 0.0 109.496 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.457 ' HB3' ' HA ' ' B' ' 37' ' ' ASN . 2.9 p . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.185 -0.947 . . . . 0.0 109.489 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.577 ' CD1' ' CG2' ' B' ' 36' ' ' ILE . 43.7 mt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.489 ' N ' HG23 ' B' ' 47' ' ' ILE . 16.0 mtmt 43.54 27.02 0.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.251 -0.906 . . . . 0.0 109.516 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 170.85 -75.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.409 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -169.62 27.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.218 -0.926 . . . . 0.0 109.553 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.79 -70.24 0.27 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.217 -0.927 . . . . 0.0 109.303 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.534 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 2.0 t -87.76 -14.72 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.195 -0.941 . . . . 0.0 109.258 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.419 HG23 ' HG3' ' B' ' 33' ' ' LYS . 43.1 t -77.73 -19.16 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.116 -0.99 . . . . 0.0 109.249 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -90.09 -37.18 14.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.227 -0.921 . . . . 0.0 109.284 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -47.5 20.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.309 -0.869 . . . . 0.0 109.352 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.566 ' HB ' ' CE1' ' B' ' 76' ' ' PHE . 31.1 m -55.3 -46.2 78.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.229 -0.919 . . . . 0.0 109.63 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.506 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -43.16 -47.47 6.23 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.204 -0.935 . . . . 0.0 109.887 -179.675 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.17 -56.42 21.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 109.824 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.509 HG22 ' CE ' ' B' ' 79' ' ' MET . 4.7 t -67.64 -9.43 43.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.201 -0.937 . . . . 0.0 109.803 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.642 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -97.95 -11.47 23.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 0.0 109.52 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.438 ' OD2' ' SD ' ' B' ' 57' ' ' MET . 48.9 m-20 -83.47 114.78 21.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.355 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -101.24 -17.31 16.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.935 . . . . 0.0 109.67 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -141.06 8.97 2.1 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.157 -0.965 . . . . 0.0 109.741 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.455 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 71.79 94.48 0.08 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 1.0 OUTLIER 169.22 -28.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.333 -1.098 . . . . 0.0 108.45 -179.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.48 -5.69 29.84 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.503 ' HB3' ' CD ' ' B' ' 26' ' ' LYS . 1.8 mm-40 -69.91 110.34 4.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -1.147 . . . . 0.0 109.219 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 14.3 t -87.89 156.49 19.34 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.179 -0.951 . . . . 0.0 109.675 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.452 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.6 OUTLIER -116.33 170.9 8.19 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.588 ' CG ' ' OG1' ' A' ' 82' ' ' THR . 1.2 t80 -57.73 -51.58 68.97 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.197 -0.94 . . . . 0.0 110.167 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.53 ' HA ' ' CB ' ' A' ' 78' ' ' ALA . 4.0 pt20 -53.81 -44.05 69.87 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.466 -0.771 . . . . 0.0 109.3 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' B' ' 76' ' ' PHE . 3.3 mt-10 -74.05 -19.37 60.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.328 -0.857 . . . . 0.0 109.617 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.494 ' CZ ' ' CG1' ' B' ' 13' ' ' VAL . 12.6 t80 -65.7 -63.1 1.17 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.244 -0.91 . . . . 0.0 109.178 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.54 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.5 OUTLIER -58.65 -46.07 87.93 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.196 -0.94 . . . . 0.0 108.743 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.465 ' HB1' ' HA ' ' A' ' 75' ' ' ALA . . . -58.44 -26.53 63.43 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.221 -0.924 . . . . 0.0 108.525 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CD2' ' CD2' ' B' ' 60' ' ' LEU . 1.0 OUTLIER -64.17 -69.26 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.489 ' O ' ' CB ' ' B' ' 81' ' ' THR . 39.3 t -51.68 -23.65 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.437 -0.789 . . . . 0.0 109.122 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.529 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -63.95 -45.58 88.51 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.289 -0.882 . . . . 0.0 109.304 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.544 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 42.7 mtm -78.03 -64.35 1.18 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.89 . . . . 0.0 109.677 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.614 ' CG2' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -46.89 -23.04 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 O-C-N 120.481 -1.387 . . . . 0.0 109.526 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.489 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 4.8 m -78.85 -67.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.04 -1.037 . . . . 0.0 109.113 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.2 t -77.1 -49.3 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.0 109.037 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.563 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.92 -39.86 0.25 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.747 -0.595 . . . . 0.0 109.966 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 29.6 t -67.55 -49.38 63.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.242 -0.911 . . . . 0.0 109.554 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -9.93 51.73 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.564 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 87' ' ' PHE . 1.6 tm-20 -89.9 -23.65 21.56 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.229 -0.919 . . . . 0.0 109.525 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' B' ' 86' ' ' GLU . 3.4 t80 . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.401 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 1.2 m . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.527 ' CG ' HD23 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -62.1 -39.2 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.257 -0.902 . . . . 0.0 109.612 -179.913 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.552 ' N ' ' CD2' ' A' ' 3' ' ' LEU . 3.2 mm? -80.56 -28.52 37.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.24 -0.912 . . . . 0.0 109.551 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 8.8 tp10 -64.9 -58.64 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mmtt -65.79 -37.75 87.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.253 -0.904 . . . . 0.0 109.581 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' CA ' ' HB3' ' B' ' 6' ' ' ALA . . . -67.59 -18.45 64.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.617 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.459 ' CG ' HD13 ' A' ' 11' ' ' ILE . 14.4 ttp -82.6 -49.68 9.59 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.928 . . . . 0.0 109.561 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.95 -27.71 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB2' ' O ' ' B' ' 2' ' ' GLU . . . -78.29 -65.63 0.95 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.576 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.512 HD21 ' CZ ' ' A' ' 73' ' ' PHE . 19.9 mt -49.76 -46.13 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.585 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.459 HD13 ' CG ' ' A' ' 7' ' ' MET . 50.8 mt -58.88 -44.86 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.523 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 26.4 t0 -62.59 -21.42 65.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.592 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 2.8 t -85.25 -26.0 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.2 -0.938 . . . . 0.0 109.425 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 2.9 t80 -72.43 -52.08 17.49 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.974 -1.078 . . . . 0.0 109.285 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.457 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 0.3 OUTLIER -74.48 -30.31 61.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.885 . . . . 0.0 109.635 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 25.3 tt0 -72.4 -63.32 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 0.0 109.603 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.571 ' CG ' HD22 ' A' ' 35' ' ' LEU . 11.2 m-85 -56.44 -28.86 60.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.251 -0.905 . . . . 0.0 109.411 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.465 ' OG ' ' O ' ' A' ' 14' ' ' PHE . 60.8 p -77.59 -31.0 52.73 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.498 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.51 -22.56 63.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.52 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 17.3 mtp85 -69.04 -27.6 65.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -1.144 . . . . 0.0 109.453 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.521 ' CG ' ' N ' ' A' ' 22' ' ' GLY . 46.8 tt0 -97.91 165.74 11.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.252 -0.905 . . . . 0.0 109.393 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.521 ' N ' ' CG ' ' A' ' 21' ' ' GLU . . . -43.93 -63.01 2.42 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.01 -177.68 0.28 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.284 -1.127 . . . . 0.0 109.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 15' ' ' HIS . 28.8 mtmt -143.69 45.56 1.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.253 -0.905 . . . . 0.0 109.469 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.427 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t60 -164.91 25.7 0.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 109.455 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.488 ' HD2' ' CB ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -170.03 170.21 7.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.264 -0.898 . . . . 0.0 109.486 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 35' ' ' LEU . 9.7 mp -120.49 164.69 16.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -122.59 69.65 0.98 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.235 -0.916 . . . . 0.0 109.504 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 63.05 -83.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.618 -0.676 . . . . 0.0 110.686 179.441 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -46.68 -35.4 5.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.146 -0.971 . . . . 0.0 110.86 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.549 ' HB3' ' CG ' ' A' ' 27' ' ' LEU . 1.7 mp0 -62.64 -42.3 99.52 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 108.851 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 5.1 mt -57.6 -56.62 19.6 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.534 ' HG2' ' CG1' ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.5 -45.35 4.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.426 -0.796 . . . . 0.0 109.431 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.423 ' HG2' ' NH2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -63.86 -42.39 97.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.346 -0.846 . . . . 0.0 109.616 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.592 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 18.6 mt -48.18 -60.25 2.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.26 -0.9 . . . . 0.0 109.799 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.647 ' CD1' ' CE2' ' A' ' 76' ' ' PHE . 1.8 mp -75.55 -16.9 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.308 -0.87 . . . . 0.0 109.729 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.452 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 m-80 -93.62 1.09 56.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.188 -0.945 . . . . 0.0 109.709 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 34' ' ' GLU . 14.7 t30 -117.1 -25.39 7.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.138 -0.977 . . . . 0.0 109.295 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.521 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 68.8 mm-40 -126.58 -10.14 6.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.901 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.523 ' CB ' HG22 ' A' ' 36' ' ' ILE . 0.3 OUTLIER -120.08 56.61 0.96 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.042 -1.036 . . . . 0.0 109.489 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.7 p . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.301 -0.874 . . . . 0.0 109.385 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.51 ' CD1' HG22 ' A' ' 53' ' ' VAL . 8.2 mm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.6 mttt -86.27 61.82 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.252 -0.905 . . . . 0.0 109.251 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.5 OUTLIER 83.29 -42.49 0.1 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 109.647 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.485 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 2.1 mt-30 167.43 57.95 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.093 -1.004 . . . . 0.0 109.341 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 2.0 tt0 -89.29 -70.34 0.66 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.157 -0.964 . . . . 0.0 109.587 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.529 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.1 t -90.54 -20.74 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.113 -0.992 . . . . 0.0 109.238 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.534 ' CG1' ' HG2' ' A' ' 33' ' ' LYS . 24.9 t -77.22 -29.11 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.156 -0.965 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.485 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 0.5 OUTLIER -90.12 -32.41 16.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.38 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 1.1 tmtp? -75.88 -37.76 58.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.407 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.533 ' HB ' ' CD1' ' A' ' 60' ' ' LEU . 8.8 m -56.35 -53.2 42.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.211 -0.93 . . . . 0.0 109.748 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.484 ' C ' ' O ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -40.16 -28.91 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.155 -0.966 . . . . 0.0 109.53 -179.713 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -75.03 -50.54 16.18 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' A' ' 60' ' ' LEU . 14.3 m -79.19 -64.8 1.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 108.794 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.637 ' CD2' ' CD2' ' A' ' 76' ' ' PHE . 4.2 mp -38.09 -47.82 1.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.708 -0.62 . . . . 0.0 109.756 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' HB2' ' O ' ' A' ' 57' ' ' MET . 0.5 OUTLIER -88.3 86.9 7.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.54 -7.64 7.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.513 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -78.27 -41.7 33.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.488 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.46 2.12 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -177.28 -35.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.244 -1.151 . . . . 0.0 108.593 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.35 -13.38 36.51 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.488 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 8.5 mt-10 -108.67 147.38 31.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -1.13 . . . . 0.0 109.515 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.52 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 1.9 t -69.79 147.74 50.04 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.307 -0.87 . . . . 0.0 109.601 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -116.63 170.98 8.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.513 -0.742 . . . . 0.0 109.359 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -61.45 -52.05 66.16 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.346 -0.847 . . . . 0.0 110.453 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -51.94 -39.32 59.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.327 -0.858 . . . . 0.0 109.548 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.52 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 1.6 pt-20 -79.6 -22.58 43.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.157 -0.965 . . . . 0.0 109.637 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.574 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 10.8 t80 -62.28 -59.53 4.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 109.003 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.528 ' HG2' ' CG ' ' B' ' 74' ' ' MET . 2.4 ttm -65.22 -44.8 87.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.314 -0.867 . . . . 0.0 109.1 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.524 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -60.24 -22.17 62.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.009 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.647 ' CE2' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.48 -63.59 1.09 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.815 . . . . 0.0 108.838 179.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.498 ' O ' ' CB ' ' A' ' 81' ' ' THR . 42.0 t -56.52 -23.1 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.543 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -63.48 -49.97 71.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.499 -0.751 . . . . 0.0 109.065 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 83' ' ' ALA . 39.1 mtp -72.77 -70.11 0.37 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.388 -0.82 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.558 HG23 ' CD1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.25 -25.84 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 120.575 -1.328 . . . . 0.0 110.02 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.514 ' CG2' HD12 ' B' ' 11' ' ' ILE . 4.6 m -77.67 -69.96 0.51 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.936 -1.102 . . . . 0.0 108.629 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -77.8 -49.91 13.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.093 -1.004 . . . . 0.0 108.325 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.581 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -39.25 -48.21 1.77 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.371 0.605 . . . . 0.0 109.453 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 13.4 t -61.03 -46.3 91.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.317 -0.864 . . . . 0.0 109.403 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -68.43 -11.19 59.34 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.456 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' A' ' 87' ' ' PHE . 4.8 tp10 -86.99 -37.26 17.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.4 ' C ' ' O ' ' A' ' 86' ' ' GLU . 49.2 t80 . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.535 ' HB3' ' N ' ' B' ' 5' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 2.5 mp0 39.23 -93.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.577 -0.702 . . . . 0.0 110.249 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.521 ' HB2' ' CB ' ' A' ' 39' ' ' GLU . 20.5 mt -75.83 -50.41 15.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.932 . . . . 0.0 109.43 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.463 ' HB3' ' HB3' ' B' ' 1' ' ' SER . 0.9 OUTLIER -49.87 -34.54 20.43 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.176 -0.952 . . . . 0.0 109.023 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.535 ' N ' ' HB3' ' B' ' 1' ' ' SER . 0.5 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.256 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.503 ' HB3' ' CA ' ' A' ' 6' ' ' ALA . . . -66.15 -10.0 36.91 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 109.339 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' B' ' 11' ' ' ILE . 4.0 mtp -80.5 -57.71 3.46 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.267 -0.895 . . . . 0.0 109.392 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 16.5 t -64.23 -32.71 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.3 -0.875 . . . . 0.0 109.351 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 2' ' ' GLU . . . -70.19 -68.9 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.333 -0.854 . . . . 0.0 109.561 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.632 ' CD2' ' CZ ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -51.3 -60.39 3.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.255 -0.903 . . . . 0.0 109.493 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.514 HD12 ' CG2' ' A' ' 81' ' ' THR . 28.2 mt -42.86 -41.06 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -59.12 -47.92 83.49 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.364 -0.835 . . . . 0.0 109.659 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.615 ' CG1' ' CZ ' ' B' ' 73' ' ' PHE . 1.0 OUTLIER -61.23 -34.05 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.137 -0.977 . . . . 0.0 109.673 -179.616 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.576 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 9.1 t80 -60.11 -70.32 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.045 -1.034 . . . . 0.0 109.159 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -64.79 -9.82 23.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.723 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.473 ' HB3' ' HA ' ' B' ' 13' ' ' VAL . 56.7 tp60 -75.49 -69.93 0.45 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.834 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.636 ' CZ ' ' CD2' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -100.26 21.37 13.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.145 -0.972 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 2.5 t -80.86 -19.9 43.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 109.328 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.502 ' CA ' ' HA ' ' B' ' 24' ' ' LYS . . . -103.1 8.71 53.94 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.455 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 22.1 mmt180 -52.89 -54.28 36.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -1.177 . . . . 0.0 109.449 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' CE ' ' B' ' 28' ' ' LYS . 1.0 OUTLIER -127.91 103.55 7.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.57 -147.48 16.42 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.464 ' O ' ' HA2' ' B' ' 19' ' ' GLY . 0.2 OUTLIER -71.41 167.28 19.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.249 -1.147 . . . . 0.0 109.474 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.502 ' HA ' ' CA ' ' B' ' 19' ' ' GLY . 3.5 mttp -104.93 40.85 1.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.924 . . . . 0.0 109.496 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -134.17 11.39 3.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.226 -0.921 . . . . 0.0 109.437 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.5 OUTLIER -161.71 169.99 20.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.458 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.584 HD23 ' CZ ' ' B' ' 17' ' ' TYR . 59.1 mt -120.61 141.01 50.73 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.707 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.52 ' CE ' ' O ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -87.25 165.72 15.46 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.49 ' N ' ' HD3' ' B' ' 29' ' ' LYS . 6.8 mmtp -42.72 -31.86 0.52 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.267 -0.896 . . . . 0.0 109.011 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 30.6 p -73.5 -58.0 3.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.443 -0.786 . . . . 0.0 110.189 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.544 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 1.6 mp0 -45.61 -44.32 12.97 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.047 -1.033 . . . . 0.0 109.117 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.585 ' CD1' ' CE ' ' B' ' 57' ' ' MET . 24.7 mt -54.09 -62.74 1.46 Allowed 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.512 ' HG3' ' CG1' ' B' ' 53' ' ' VAL . 0.2 OUTLIER -47.26 -23.17 0.5 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.893 . . . . 0.0 110.072 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' B' ' 30' ' ' SER . 23.2 mm-40 -75.82 -70.28 0.44 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.976 -1.078 . . . . 0.0 109.99 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.636 ' CD2' ' CZ ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -42.98 -33.03 0.72 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.414 -0.804 . . . . 0.0 109.634 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.574 HG13 ' CZ ' ' B' ' 76' ' ' PHE . 14.5 mt -72.5 -45.24 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.152 -0.967 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.43 ' O ' ' HB3' ' B' ' 41' ' ' SER . 1.9 m-80 -72.6 -9.36 58.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.539 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.56 -51.21 7.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.913 . . . . 0.0 109.369 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.524 ' CG ' ' HB3' ' A' ' 3' ' ' LEU . 1.3 tt0 -102.67 -43.43 5.6 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.0 109.348 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.517 ' CD1' ' HB ' ' B' ' 80' ' ' VAL . 1.0 OUTLIER -86.63 58.75 5.24 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 109.484 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' B' ' 37' ' ' ASN . 6.8 p . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.439 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.527 ' CD1' HG22 ' B' ' 53' ' ' VAL . 1.8 mm . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.507 ' CE ' ' CG ' ' B' ' 51' ' ' GLU . 9.8 pttt -43.26 -45.51 5.83 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.238 -0.914 . . . . 0.0 109.544 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.476 ' CG ' ' C ' ' B' ' 48' ' ' LYS . 7.1 mt-10 -154.83 -39.65 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.875 . . . . 0.0 109.301 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 167.72 58.97 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.319 -0.863 . . . . 0.0 109.383 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.507 ' CG ' ' CE ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -86.45 -70.29 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.34 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.522 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.4 t -87.78 -27.11 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.929 . . . . 0.0 109.047 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.527 HG22 ' CD1' ' B' ' 47' ' ' ILE . 54.5 t -68.18 -20.42 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.306 -0.871 . . . . 0.0 109.042 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 4.8 t0 -90.16 -51.37 5.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.354 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -58.06 -33.88 69.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.528 ' HB ' ' CD1' ' B' ' 60' ' ' LEU . 25.3 m -58.56 -50.82 77.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.168 -0.957 . . . . 0.0 109.519 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.585 ' CE ' ' CD1' ' B' ' 32' ' ' LEU . 0.8 OUTLIER -44.91 -26.25 0.39 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.923 -1.11 . . . . 0.0 109.373 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' B' ' 56' ' ' VAL . 9.8 mt-10 -74.9 -47.08 31.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.264 -0.897 . . . . 0.0 108.978 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.464 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 45.0 m -85.01 -63.47 1.32 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.274 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.59 HD23 ' CE1' ' B' ' 76' ' ' PHE . 10.7 mp -38.33 -32.99 0.08 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.608 -0.682 . . . . 0.0 109.902 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' HE1' ' B' ' 57' ' ' MET . 76.0 m-20 -90.15 112.35 23.81 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.182 -0.949 . . . . 0.0 109.553 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.495 ' ND2' ' OE2' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -124.95 -29.3 3.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.225 -0.922 . . . . 0.0 109.641 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -82.17 -12.18 58.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.225 -0.922 . . . . 0.0 109.612 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 70.08 85.92 0.14 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 12.9 t0 178.14 -32.32 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.321 -1.105 . . . . 0.0 108.678 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.449 ' HA2' ' HE2' ' B' ' 29' ' ' LYS . . . 110.36 38.22 1.67 Allowed Glycine 0 N--CA 1.485 1.938 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -135.42 119.52 17.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.337 -1.096 . . . . 0.0 109.335 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.473 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 16.4 t -69.73 156.96 38.2 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 0.0 109.854 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.473 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.5 OUTLIER -120.64 171.77 8.34 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -62.6 -50.94 69.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.353 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.463 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 2.8 pt20 -55.45 -40.18 71.25 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.139 -0.975 . . . . 0.0 108.944 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.495 ' OE2' ' ND2' ' B' ' 62' ' ' ASN . 0.8 OUTLIER -78.95 -17.9 54.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.314 -0.866 . . . . 0.0 109.184 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.632 ' CZ ' ' CD2' ' B' ' 10' ' ' LEU . 5.3 t80 -65.41 -57.34 8.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.543 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -64.01 -42.13 97.24 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.011 -1.056 . . . . 0.0 108.408 179.136 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.524 ' HB1' ' CB ' ' A' ' 75' ' ' ALA . . . -67.64 -16.34 64.11 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.335 -0.853 . . . . 0.0 108.798 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.59 ' CE1' HD23 ' B' ' 60' ' ' LEU . 2.1 t80 -71.8 -62.63 1.35 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.456 ' O ' ' OG1' ' B' ' 81' ' ' THR . 75.2 t -62.0 -26.77 40.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.525 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -60.77 -44.72 96.4 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.39 -0.819 . . . . 0.0 109.099 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 12.8 mtp -73.67 -69.88 0.41 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.276 -0.89 . . . . 0.0 109.155 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.522 ' CG1' HG13 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -41.86 -26.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.7 -1.25 . . . . 0.0 109.615 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.502 ' N ' ' O ' ' B' ' 79' ' ' MET . 12.5 m -75.64 -70.09 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.043 -1.036 . . . . 0.0 108.868 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.569 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.9 t -78.07 -49.45 13.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.121 -0.987 . . . . 0.0 108.574 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.569 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -38.31 -41.53 0.63 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.257 0.551 . . . . 0.0 109.856 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.94 -36.45 27.98 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 109.649 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.8 t-160 -67.96 -9.95 49.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.165 -0.959 . . . . 0.0 109.658 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.514 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 1.4 pp20? -80.64 -13.43 59.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 109.61 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.168 -0.957 . . . . 0.0 109.545 -179.937 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.438 ' CB ' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.526 ' OE1' ' CB ' ' B' ' 9' ' ' ALA . 0.2 OUTLIER -63.9 -71.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.523 ' CB ' ' CG ' ' B' ' 39' ' ' GLU . 0.9 OUTLIER -68.72 -24.54 64.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.538 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.438 ' HB2' ' CB ' ' A' ' 1' ' ' SER . 0.2 OUTLIER -59.67 -52.8 63.94 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.457 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -65.86 -48.89 70.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.517 ' CB ' ' HB2' ' B' ' 6' ' ' ALA . . . -60.81 -17.47 49.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.9 ttp -77.68 -61.43 1.99 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.197 -0.939 . . . . 0.0 109.54 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.473 HG11 ' N ' ' A' ' 9' ' ' ALA . 9.8 p -49.69 -34.2 8.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.258 -0.902 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.473 ' N ' HG11 ' A' ' 8' ' ' VAL . . . -66.42 -66.4 0.56 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.506 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.421 ' HG ' HD23 ' B' ' 3' ' ' LEU . 0.3 OUTLIER -45.42 -25.73 0.46 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.451 HD12 ' CZ ' ' A' ' 70' ' ' PHE . 17.7 mm -68.93 -53.85 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.267 -0.896 . . . . 0.0 109.498 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.53 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 7.4 t0 -61.48 -18.73 60.35 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.31 -0.869 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.58 HG12 ' CD1' ' A' ' 17' ' ' TYR . 2.1 t -87.67 -28.84 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.254 -0.904 . . . . 0.0 109.374 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 5.1 t80 -70.05 -46.53 64.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.018 -1.051 . . . . 0.0 109.339 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -80.5 -34.53 35.67 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.329 -0.857 . . . . 0.0 109.711 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.1 tt0 -65.17 -57.74 7.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.2 -0.938 . . . . 0.0 109.606 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.58 ' CD1' HG12 ' A' ' 13' ' ' VAL . 50.6 m-85 -65.45 -33.51 76.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.899 . . . . 0.0 109.569 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.515 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 59.9 p -82.23 0.96 38.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.216 -0.927 . . . . 0.0 109.698 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.94 -22.86 75.95 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 5.2 mtt-85 -77.03 -15.47 59.6 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.261 -1.141 . . . . 0.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -93.52 168.2 11.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 109.439 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.73 -38.1 57.07 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 1.8 m-20 -62.47 -34.92 77.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.126 . . . . 0.0 109.439 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 16.6 mtpt 74.97 0.82 3.64 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.579 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.2 m170 -138.11 7.42 2.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.0 109.573 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.527 ' CD ' ' O ' ' A' ' 68' ' ' CYS . 1.0 OUTLIER -137.83 142.98 40.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.205 -0.934 . . . . 0.0 109.437 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.54 ' CD2' ' HB3' ' A' ' 31' ' ' GLU . 6.7 mp -86.85 161.15 18.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.171 -0.956 . . . . 0.0 109.51 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.52 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -126.59 73.73 1.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.291 -0.881 . . . . 0.0 109.279 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 2.6 tttm 63.71 -84.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.607 -0.683 . . . . 0.0 110.267 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 m -44.69 -48.24 10.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.168 -0.957 . . . . 0.0 110.535 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.54 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -56.62 -39.86 74.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.926 -1.109 . . . . 0.0 109.358 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.553 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 25.0 mt -60.88 -65.81 0.63 Allowed 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.542 -0.724 . . . . 0.0 109.208 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HG2' ' CD1' ' A' ' 47' ' ' ILE . 3.7 ttpt -42.74 -27.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.346 -0.846 . . . . 0.0 109.527 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -67.22 -63.98 0.95 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.211 -0.931 . . . . 0.0 109.353 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.573 HD11 ' CD2' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -44.32 -32.91 1.45 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.879 . . . . 0.0 109.528 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 53' ' ' VAL . 1.5 mp -70.13 -49.89 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.937 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.442 ' OD1' HD13 ' A' ' 47' ' ' ILE . 2.7 m-20 -86.96 11.91 12.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 109.659 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.417 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -109.46 -40.96 4.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.163 -0.961 . . . . 0.0 109.517 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.522 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 0.0 OUTLIER -121.61 -22.53 5.84 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.631 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.522 ' CD1' ' HB ' ' A' ' 80' ' ' VAL . 16.9 mt -97.18 33.4 1.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.144 -0.973 . . . . 0.0 109.438 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.457 179.904 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.527 ' CG2' HG22 ' A' ' 53' ' ' VAL . 33.0 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.2 mtmt 75.16 26.28 1.24 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.277 -0.89 . . . . 0.0 109.322 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 tt0 83.33 -43.38 0.1 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.693 -0.629 . . . . 0.0 109.802 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.418 ' CD ' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -178.15 54.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.075 -1.015 . . . . 0.0 109.499 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HB2' ' HB2' ' A' ' 48' ' ' LYS . 50.2 tp10 -90.03 -70.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.487 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.529 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 1.7 t -90.97 -16.12 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.173 -0.954 . . . . 0.0 109.316 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.527 HG22 ' CG2' ' A' ' 47' ' ' ILE . 41.2 t -80.76 -24.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.0 108.96 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.82 -33.07 21.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 109.119 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -41.97 26.83 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.35 -0.844 . . . . 0.0 109.293 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.526 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 28.6 m -58.81 -49.24 83.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 O-C-N 121.251 -0.906 . . . . 0.0 109.493 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.553 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 4.3 tpt -42.97 -27.01 0.16 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.505 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 56' ' ' VAL . 2.0 tm-20 -79.04 -45.68 19.67 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.266 -0.897 . . . . 0.0 109.114 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 60' ' ' LEU . 22.3 m -79.03 -63.48 1.41 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 109.505 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.525 ' CG ' ' HB2' ' A' ' 76' ' ' PHE . 7.6 mp -37.92 -43.85 0.73 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.613 -0.679 . . . . 0.0 109.955 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.491 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 8.0 m-20 -90.11 69.99 7.29 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.159 -0.963 . . . . 0.0 109.453 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -95.69 -9.4 32.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' O ' ' A' ' 67' ' ' GLU . 2.7 p-10 -78.86 -13.45 59.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.182 -0.948 . . . . 0.0 109.503 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 65.26 83.86 0.09 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 13.5 t0 177.63 -32.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.206 -1.173 . . . . 0.0 108.658 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.24 36.57 1.94 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' OD1' ' A' ' 63' ' ' ASP . 39.5 mt-10 -148.94 124.18 10.19 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.299 -1.118 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.527 ' O ' ' CD ' ' A' ' 26' ' ' LYS . 14.0 t -69.9 155.23 40.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.199 -0.938 . . . . 0.0 109.659 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.463 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -115.47 171.27 7.82 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 179.679 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.523 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -60.77 -49.73 76.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 110.149 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' B' ' 79' ' ' MET . 50.4 mt-30 -54.72 -43.42 72.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 108.997 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.463 ' HG3' ' HB2' ' A' ' 69' ' ' ASP . 1.4 mt-10 -76.78 -16.95 59.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.392 -0.818 . . . . 0.0 109.649 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.567 ' CE2' HG11 ' A' ' 13' ' ' VAL . 13.7 t80 -71.08 -52.92 16.67 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.049 -1.032 . . . . 0.0 109.161 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.527 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.6 OUTLIER -65.14 -42.23 94.03 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.162 -0.961 . . . . 0.0 108.785 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.48 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -66.7 -25.17 66.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 108.734 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.579 ' CE1' HG22 ' A' ' 80' ' ' VAL . 0.2 OUTLIER -64.21 -63.0 1.26 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.518 ' CG1' ' CE ' ' B' ' 7' ' ' MET . 96.9 t -62.59 -25.4 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.313 -0.867 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.532 ' HB1' ' CB ' ' B' ' 74' ' ' MET . . . -68.85 -29.08 67.33 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.455 -0.778 . . . . 0.0 109.065 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.594 ' O ' ' N ' ' A' ' 83' ' ' ALA . 19.5 mtp -84.59 -70.88 0.55 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.31 -0.869 . . . . 0.0 109.188 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.579 HG22 ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -44.9 -25.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 O-C-N 120.416 -1.428 . . . . 0.0 109.458 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.512 ' CG2' ' SD ' ' B' ' 7' ' ' MET . 41.7 m -81.75 -63.71 1.33 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 108.499 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.567 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 2.0 m -79.91 -54.6 5.66 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.594 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -36.51 -43.7 0.41 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.321 0.581 . . . . 0.0 109.753 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -71.14 -45.16 64.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.405 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 82' ' ' THR . 1.9 m-70 -62.43 -13.64 32.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.234 -0.916 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.88 -48.09 17.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.411 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.23 -0.919 . . . . 0.0 109.416 179.96 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.418 ' N ' ' HB3' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' B' ' 2' ' ' GLU . 1.1 tp10 -64.76 -76.46 0.07 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.249 -0.907 . . . . 0.0 109.444 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.522 ' HB2' ' CB ' ' A' ' 39' ' ' GLU . 12.1 mt -69.73 -21.4 63.46 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -0.936 . . . . 0.0 109.438 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.418 ' HB3' ' N ' ' B' ' 1' ' ' SER . 2.9 tt0 -63.92 -51.7 63.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 109.396 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -43.02 71.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.894 . . . . 0.0 109.4 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.517 ' HB2' ' CB ' ' A' ' 6' ' ' ALA . . . -71.7 -12.3 61.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.525 ' HE2' ' CE ' ' B' ' 74' ' ' MET . 16.7 tpp -83.71 -45.17 13.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 53.2 t -68.63 -34.15 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . . . -72.07 -58.48 3.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.513 ' CD1' ' HB2' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -51.95 -55.24 21.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.262 -0.899 . . . . 0.0 109.476 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.453 HG13 ' SD ' ' B' ' 7' ' ' MET . 21.1 mt -47.85 -46.48 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.875 . . . . 0.0 109.5 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' B' ' 16' ' ' GLN . 5.0 t0 -56.63 -42.78 79.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.886 . . . . 0.0 109.549 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.591 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 2.2 t -64.27 -25.51 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.243 -0.911 . . . . 0.0 109.572 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.575 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 31.1 t80 -72.05 -40.26 68.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.938 -1.101 . . . . 0.0 109.596 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.575 ' CE1' ' HG2' ' B' ' 24' ' ' LYS . 18.1 t60 -74.03 -38.2 64.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.915 . . . . 0.0 110.271 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -74.67 -59.62 2.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.68 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.566 ' CD1' HG12 ' B' ' 13' ' ' VAL . 15.6 m-85 -55.01 -31.89 61.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.323 -0.86 . . . . 0.0 109.496 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 37.5 p -86.6 -22.02 26.47 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.201 -0.937 . . . . 0.0 109.51 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.468 ' CA ' ' HG3' ' B' ' 24' ' ' LYS . . . -83.56 -13.59 75.55 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 37.6 mtp85 -64.17 -61.88 1.97 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -1.19 . . . . 0.0 109.46 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -133.77 124.98 27.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.66 -108.31 0.82 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -150.8 27.6 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -1.113 . . . . 0.0 109.479 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.575 ' HG2' ' CE1' ' B' ' 15' ' ' HIS . 0.0 OUTLIER 53.82 61.1 3.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 109.464 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.575 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 2.2 m170 -170.14 -35.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.585 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.579 ' CB ' ' CB ' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -129.19 170.35 13.67 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.56 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.553 ' CD1' ' CD1' ' B' ' 35' ' ' LEU . 70.1 mt -119.09 136.97 53.88 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.218 -0.926 . . . . 0.0 110.022 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -86.6 165.96 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.514 ' CG ' ' SD ' ' B' ' 57' ' ' MET . 0.1 OUTLIER -42.84 -26.94 0.15 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.982 . . . . 0.0 109.87 -179.708 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -78.65 -49.38 13.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.208 -0.932 . . . . 0.0 110.411 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.544 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 37.1 mm-40 -55.98 -41.85 75.43 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.982 -1.074 . . . . 0.0 108.663 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.588 ' CD2' ' CD1' ' B' ' 60' ' ' LEU . 2.1 mt -57.61 -65.98 0.54 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.792 -0.568 . . . . 0.0 109.615 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.511 ' CG ' HG12 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.34 -30.96 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.367 -0.833 . . . . 0.0 109.648 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -67.91 0.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.923 . . . . 0.0 109.301 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.591 ' CD2' ' CG1' ' B' ' 13' ' ' VAL . 12.1 mt -45.72 -25.46 0.49 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 109.547 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.582 HD13 ' CZ ' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -70.84 -59.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 108.91 179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -78.89 4.83 13.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 109.708 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.07 -11.11 9.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.399 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.523 ' CG ' ' CB ' ' A' ' 3' ' ' LEU . 5.4 tm-20 -101.94 -40.74 6.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 0.0 109.4 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.535 ' O ' ' CB ' ' B' ' 41' ' ' SER . 2.7 mm? -88.22 -46.72 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.255 -0.903 . . . . 0.0 109.393 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.0 t . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.382 -0.824 . . . . 0.0 109.261 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.561 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 14.0 mm . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 6.2 mtmt 83.37 -60.12 0.13 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.639 -0.663 . . . . 0.0 109.973 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.426 ' HG3' ' HG2' ' B' ' 50' ' ' GLN . 5.4 pt-20 -143.88 -46.55 0.27 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.057 -1.027 . . . . 0.0 109.637 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -164.93 31.05 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.955 . . . . 0.0 109.721 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.15 -70.4 0.24 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -1.0 . . . . 0.0 109.082 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.53 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 2.1 t -84.11 -9.61 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.0 109.037 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.531 ' CG2' HD11 ' B' ' 47' ' ' ILE . 2.2 t -82.5 -31.61 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.065 -1.022 . . . . 0.0 109.099 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 1.4 t70 -90.33 -29.57 18.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.411 -0.806 . . . . 0.0 109.191 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -84.39 -44.64 13.54 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.332 -0.855 . . . . 0.0 109.398 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.53 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 0.8 OUTLIER -68.2 -42.84 85.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 O-C-N 121.125 -0.984 . . . . 0.0 109.314 179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.519 ' CE ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.88 -55.0 2.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 110.318 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -58.44 -40.65 83.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.954 . . . . 0.0 109.323 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.525 ' CG2' ' SD ' ' B' ' 79' ' ' MET . 99.4 m -67.61 -20.2 65.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 110.356 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.588 ' CD1' ' CD2' ' B' ' 32' ' ' LEU . 0.3 OUTLIER -82.2 -72.48 0.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.932 -1.105 . . . . 0.0 109.151 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.26 100.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 0.0 109.496 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.92 9.08 4.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.275 -0.891 . . . . 0.0 109.545 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.91 -29.78 9.27 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.936 . . . . 0.0 109.405 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.76 2.13 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -175.26 -36.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.257 -1.143 . . . . 0.0 108.521 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 -12.9 50.68 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.579 ' CB ' ' CB ' ' B' ' 26' ' ' LYS . 1.7 mm-40 -112.24 150.54 30.77 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.257 -1.143 . . . . 0.0 109.457 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.532 ' SG ' ' CD2' ' B' ' 32' ' ' LEU . 7.2 m -73.74 155.77 38.58 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.203 -0.936 . . . . 0.0 110.199 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.41 171.5 7.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.481 -0.762 . . . . 0.0 109.196 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.567 ' CG ' ' OG1' ' A' ' 82' ' ' THR . 0.2 OUTLIER -57.88 -53.63 56.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.238 -0.914 . . . . 0.0 110.672 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' B' ' 72' ' ' GLU . 1.9 pt20 -62.31 -29.99 70.83 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.23 -0.919 . . . . 0.0 108.687 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.481 ' N ' ' HG3' ' B' ' 71' ' ' GLN . 1.1 tt0 -81.78 -15.25 54.86 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.563 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 5.7 t80 -75.35 -52.3 11.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.185 -0.947 . . . . 0.0 108.938 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.532 ' CB ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -66.64 -45.82 77.78 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.891 . . . . 0.0 109.188 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.525 ' O ' ' CE ' ' B' ' 79' ' ' MET . . . -59.09 -43.41 91.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 108.922 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.582 ' CZ ' HD13 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -49.15 -60.11 3.08 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.525 HG13 ' CE ' ' A' ' 74' ' ' MET . 44.0 t -59.92 -25.57 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.342 -0.848 . . . . 0.0 108.714 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.527 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -60.86 -37.31 81.69 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.52 -0.737 . . . . 0.0 109.207 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 1.1 mtm -79.11 -66.79 0.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.577 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -47.95 -22.43 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 O-C-N 120.473 -1.392 . . . . 0.0 109.218 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 16.3 m -78.42 -66.44 0.85 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.059 -1.026 . . . . 0.0 108.915 178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.8 t -81.37 -49.84 10.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.995 . . . . 0.0 108.756 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.568 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.85 -35.92 0.17 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.807 -0.558 . . . . 0.0 109.605 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 10.0 t -67.07 -52.89 36.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.367 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.49 -10.4 51.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.225 -0.922 . . . . 0.0 109.543 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -90.14 -34.56 15.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.193 -0.942 . . . . 0.0 109.493 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.901 . . . . 0.0 109.483 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.416 ' OG ' ' OE1' ' B' ' 39' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.526 ' CG ' HG22 ' B' ' 13' ' ' VAL . 1.3 mp0 -73.96 -71.24 0.34 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.299 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 3.4 mp -61.48 -18.02 57.15 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.342 -0.849 . . . . 0.0 109.404 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.456 ' O ' ' CG ' ' A' ' 7' ' ' MET . 5.2 tt0 -68.89 -66.98 0.51 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.074 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.48 ' HA ' ' CG2' ' A' ' 8' ' ' VAL . 2.5 ttmt -65.49 -14.59 61.33 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.278 -0.889 . . . . 0.0 109.055 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.526 ' O ' ' CD1' ' A' ' 10' ' ' LEU . . . -82.81 -29.4 29.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.332 -0.855 . . . . 0.0 109.117 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 8' ' ' VAL . 3.7 ptp -83.33 -23.77 32.39 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 109.251 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.5 HG22 ' N ' ' A' ' 9' ' ' ALA . 32.9 m -80.39 -44.33 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.261 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.5 ' N ' HG22 ' A' ' 8' ' ' VAL . . . -71.23 -36.38 71.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.456 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.574 HD22 ' CZ ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -75.15 -54.18 7.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 109.626 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.517 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -46.62 -45.86 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.098 -1.001 . . . . 0.0 109.352 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.517 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -67.8 -34.17 76.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.192 -0.942 . . . . 0.0 109.583 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.527 HG13 ' CD2' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -73.97 -15.42 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.2 t80 -85.78 -41.88 14.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.01 -1.056 . . . . 0.0 109.281 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.462 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 10.6 m170 -74.47 -28.91 61.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.284 -0.885 . . . . 0.0 109.352 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -79.74 -60.29 2.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.911 . . . . 0.0 109.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.565 ' CG ' ' HG ' ' A' ' 35' ' ' LEU . 37.9 m-85 -59.0 -46.09 89.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.497 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 14' ' ' PHE . 1.5 p -75.05 -11.94 60.21 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 109.481 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.518 ' HA3' ' CG ' ' A' ' 24' ' ' LYS . . . -94.99 26.62 18.0 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -90.06 -16.83 28.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -1.151 . . . . 0.0 109.569 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 23' ' ' ASP . 27.2 mt-10 -105.44 69.35 0.83 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.146 -0.971 . . . . 0.0 109.683 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.446 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . 39.58 28.43 0.12 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' N ' ' O ' ' A' ' 21' ' ' GLU . 11.9 t70 -179.47 137.26 0.13 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.098 -1.236 . . . . 0.0 109.662 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.518 ' CG ' ' HA3' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -108.83 112.94 25.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.304 -0.872 . . . . 0.0 109.383 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.427 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 3.0 t-80 -170.07 -35.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.642 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -145.06 170.2 16.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.561 ' CD2' ' HB3' ' A' ' 31' ' ' GLU . 1.7 mp -117.79 128.0 54.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.236 -0.915 . . . . 0.0 110.032 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.559 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -74.26 161.39 29.97 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.005 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.559 ' N ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -28.93 0.24 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.873 -1.142 . . . . 0.0 109.488 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 28' ' ' LYS . 3.0 m -82.29 -40.73 21.11 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.376 -0.827 . . . . 0.0 110.164 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.561 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -58.64 -40.35 83.17 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.794 -1.191 . . . . 0.0 108.483 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.626 ' CD2' ' CE2' ' A' ' 76' ' ' PHE . 17.8 mt -62.94 -61.83 2.13 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HD2' ' ND2' ' A' ' 37' ' ' ASN . 0.1 OUTLIER -42.31 -27.22 0.14 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 109.757 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.28 -67.33 0.76 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.661 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -42.02 -30.73 0.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.424 -0.797 . . . . 0.0 110.086 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.52 ' CG2' HG13 ' A' ' 80' ' ' VAL . 6.0 mm -85.38 -41.86 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.187 -0.945 . . . . 0.0 109.421 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.49 ' ND2' ' HD2' ' A' ' 33' ' ' LYS . 2.2 m-80 -87.51 11.6 14.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.551 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.459 ' HB3' ' OH ' ' A' ' 17' ' ' TYR . 2.0 m-80 -118.09 -44.72 2.68 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.448 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.467 ' HB3' ' HB2' ' B' ' 3' ' ' LEU . 13.8 mm-40 -109.32 -9.89 14.96 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.278 -0.889 . . . . 0.0 109.49 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.442 HD22 ' OG1' ' A' ' 81' ' ' THR . 5.6 mp -119.63 41.78 3.05 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 109.471 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.495 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.537 HG22 ' CG2' ' A' ' 53' ' ' VAL . 8.6 mt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.517 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 6.4 ptmt 163.23 -34.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.286 -0.883 . . . . 0.0 109.384 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.46 ' HG3' ' HG3' ' A' ' 50' ' ' GLN . 25.3 pt-20 -140.43 -38.44 0.44 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.87 . . . . 0.0 109.412 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG3' ' HG3' ' A' ' 49' ' ' GLU . 2.2 pt20 167.72 48.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.202 -0.936 . . . . 0.0 109.612 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.67 -70.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.178 -0.951 . . . . 0.0 109.281 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.536 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 2.3 t -91.63 -12.96 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.0 108.878 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.537 ' CG2' HG22 ' A' ' 47' ' ' ILE . 35.8 t -82.58 -27.51 8.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.14 -0.975 . . . . 0.0 108.84 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -90.46 -34.37 15.62 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.475 -0.766 . . . . 0.0 109.106 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -45.15 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.342 -0.849 . . . . 0.0 109.407 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.527 HG21 ' CD2' ' A' ' 60' ' ' LEU . 1.3 p -64.9 -44.04 96.24 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.064 -1.023 . . . . 0.0 109.303 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -41.01 -47.58 3.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.584 -0.698 . . . . 0.0 109.922 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.06 -44.61 97.12 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.185 -0.947 . . . . 0.0 108.848 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 m -73.24 -8.95 58.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.444 -0.785 . . . . 0.0 109.608 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.593 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . 2.9 mt -85.66 -74.69 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.145 -0.972 . . . . 0.0 109.388 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.71 93.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.61 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.26 13.32 34.7 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.261 -0.899 . . . . 0.0 109.412 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.02 -45.34 2.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.0 109.541 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.07 91.16 2.15 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.62 -36.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.301 -1.117 . . . . 0.0 108.492 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 39.81 2.12 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -156.38 113.39 3.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -1.157 . . . . 0.0 109.331 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 94.9 m -69.8 157.77 36.73 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.215 -0.928 . . . . 0.0 110.076 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.424 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -118.42 170.6 8.79 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.323 -0.861 . . . . 0.0 109.093 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.433 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.1 OUTLIER -50.56 -64.76 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.366 -0.834 . . . . 0.0 111.293 -179.216 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 5.4 pt20 -45.28 -27.95 0.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.039 -1.038 . . . . 0.0 108.732 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.604 ' O ' ' CD1' ' A' ' 76' ' ' PHE . 3.3 mt-10 -77.58 -41.8 37.51 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.501 -0.75 . . . . 0.0 110.009 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.593 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 2.6 t80 -51.51 -50.41 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.81 -1.182 . . . . 0.0 109.016 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.536 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 9.6 mtp -62.81 -38.7 91.75 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.5 -0.75 . . . . 0.0 109.347 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.441 ' HB3' ' HB1' ' B' ' 75' ' ' ALA . . . -69.6 -16.67 63.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.172 -0.955 . . . . 0.0 108.787 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.626 ' CE2' ' CD2' ' A' ' 32' ' ' LEU . 15.0 m-30 -75.14 -70.05 0.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.52 HG22 ' CD2' ' B' ' 3' ' ' LEU . 99.2 t -52.1 -29.97 12.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.056 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.521 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -62.93 -44.45 96.05 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.679 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.8 OUTLIER -76.3 -69.64 0.49 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 109.968 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.536 ' CG1' ' HB ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -44.85 -23.38 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 O-C-N 120.575 -1.328 . . . . 0.0 109.717 -178.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.51 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 15.7 m -80.4 -67.81 0.74 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.893 -1.129 . . . . 0.0 108.927 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.1 t -77.32 -49.72 14.37 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.95 . . . . 0.0 108.768 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.563 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -37.87 -30.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.408 0.623 . . . . 0.0 109.557 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.474 ' N ' ' O ' ' A' ' 82' ' ' THR . 42.9 t -89.66 -41.66 11.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.312 -0.868 . . . . 0.0 109.448 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.411 ' N ' ' O ' ' A' ' 82' ' ' THR . 36.1 t60 -63.19 -11.92 24.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.633 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' A' ' 86' ' ' GLU . 6.2 tp10 -82.06 -35.65 28.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.94 . . . . 0.0 109.442 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.3 -0.875 . . . . 0.0 109.492 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.436 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.491 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 5.2 mm-40 -64.82 -54.87 24.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.276 -0.89 . . . . 0.0 109.301 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' B' ' 3' ' ' LEU . 6.0 mp -70.98 -19.72 62.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.308 -0.87 . . . . 0.0 109.402 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.436 ' HB2' ' N ' ' B' ' 1' ' ' SER . 15.2 tp10 -63.05 -56.02 20.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.229 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.458 ' HD3' ' HD2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -64.69 -39.2 93.26 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.261 -0.899 . . . . 0.0 108.758 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.523 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -69.73 -16.12 63.27 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.299 -0.876 . . . . 0.0 109.106 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.503 ' HE3' ' CG2' ' A' ' 81' ' ' THR . 6.5 tpt -77.23 -50.55 12.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.417 -0.802 . . . . 0.0 109.26 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.437 ' O ' HG21 ' B' ' 11' ' ' ILE . 12.2 p -65.29 -31.03 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.234 -0.916 . . . . 0.0 109.476 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' B' ' 10' ' ' LEU . . . -79.88 -69.76 0.56 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.932 . . . . 0.0 109.564 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.496 HD21 ' CD1' ' A' ' 3' ' ' LEU . 36.7 mt -43.91 -45.74 7.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 109.59 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.543 ' CG2' ' N ' ' B' ' 12' ' ' ASP . 0.5 OUTLIER -61.08 -46.66 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.204 -0.935 . . . . 0.0 109.449 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.543 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 40.5 t0 -65.68 -15.2 62.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.276 -0.89 . . . . 0.0 109.475 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.586 HG11 ' CD1' ' B' ' 17' ' ' TYR . 2.2 t -89.7 -31.45 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 0.0 109.269 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.572 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 8.1 t80 -69.28 -46.13 67.95 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.995 -1.066 . . . . 0.0 109.123 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -78.14 -39.61 40.59 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.4 tt0 -62.92 -63.33 1.24 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 109.457 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.619 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 28.5 m-85 -53.7 -41.12 66.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.259 -0.9 . . . . 0.0 109.541 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.513 ' HB3' ' N ' ' B' ' 25' ' ' HIS . 1.7 m -61.51 -32.68 72.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.215 -0.928 . . . . 0.0 109.665 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.55 31.12 5.97 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.492 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 27.6 mmm180 -90.08 -30.84 17.44 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.15 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.6 mt-10 -153.71 93.99 1.73 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 109.525 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 57.99 158.16 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' C ' ' CG ' ' B' ' 24' ' ' LYS . 10.7 m-20 60.3 155.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.495 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.444 ' CG ' ' C ' ' B' ' 23' ' ' ASP . 0.9 OUTLIER -154.41 63.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.572 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -170.03 -35.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -118.98 167.27 11.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.0 109.588 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.534 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 79.6 mt -118.07 121.2 39.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.803 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.52 ' O ' ' CD1' ' B' ' 32' ' ' LEU . 0.2 OUTLIER -73.08 168.13 19.7 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.179 -0.951 . . . . 0.0 108.655 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -43.34 -26.95 0.22 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.16 -0.962 . . . . 0.0 109.537 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.423 ' N ' ' O ' ' B' ' 28' ' ' LYS . 31.2 m -74.5 -62.41 1.53 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.288 -0.883 . . . . 0.0 109.975 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.534 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 48.2 mm-40 -45.72 -42.47 11.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.092 -1.005 . . . . 0.0 109.223 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.527 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 4.3 mp -55.29 -69.44 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.601 -0.687 . . . . 0.0 109.264 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.528 ' HD3' ' CG1' ' B' ' 53' ' ' VAL . 4.5 mmtp -38.95 -32.47 0.09 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.465 -0.772 . . . . 0.0 109.744 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' B' ' 38' ' ' ASN . 0.3 OUTLIER -65.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.307 -0.87 . . . . 0.0 109.237 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.619 ' CD2' ' CD2' ' B' ' 17' ' ' TYR . 3.9 mm? -44.43 -26.15 0.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.299 -0.875 . . . . 0.0 109.464 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.534 ' CD1' ' CZ ' ' B' ' 76' ' ' PHE . 1.1 mm -75.01 -61.97 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -87.91 18.75 3.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.706 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 23.4 t-20 -114.54 -44.91 3.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -0.909 . . . . 0.0 109.261 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.524 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 18.3 mm-40 -123.46 -9.99 7.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.332 -0.855 . . . . 0.0 109.451 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' B' ' 36' ' ' ILE . 18.4 mt -109.06 52.86 0.7 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.442 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.569 179.983 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.52 ' CD1' HG23 ' B' ' 53' ' ' VAL . 42.8 mt . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.525 ' HB2' ' CG ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -86.26 61.37 6.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.224 -0.923 . . . . 0.0 109.393 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' B' ' 50' ' ' GLN . 0.5 OUTLIER 64.13 59.24 1.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.288 -0.883 . . . . 0.0 109.307 -179.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 4.2 mt-30 65.33 48.93 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.324 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.525 ' CG ' ' HB2' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -88.8 -70.15 0.66 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.211 -0.931 . . . . 0.0 109.568 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.52 HG13 ' CG1' ' B' ' 80' ' ' VAL . 1.9 t -91.46 -12.88 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.449 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.528 ' CG1' ' HD3' ' B' ' 33' ' ' LYS . 75.3 t -84.34 -25.28 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.051 -1.031 . . . . 0.0 108.793 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -88.22 -33.93 17.95 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -51.28 8.23 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.429 -0.795 . . . . 0.0 108.956 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.523 HG23 ' CD1' ' B' ' 60' ' ' LEU . 1.3 p -59.59 -40.61 82.54 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 O-C-N 121.208 -0.932 . . . . 0.0 108.92 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.527 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -42.17 -48.39 4.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.578 -0.701 . . . . 0.0 109.42 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.61 -43.2 99.41 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.291 -0.881 . . . . 0.0 109.071 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 8.3 m -66.27 -13.69 60.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.31 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.529 ' CD2' ' HB2' ' B' ' 76' ' ' PHE . 2.1 mp -95.29 -28.79 14.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 0.0 109.469 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.417 ' O ' ' C ' ' B' ' 62' ' ' ASN . 0.5 OUTLIER -65.46 114.32 4.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.214 -0.929 . . . . 0.0 109.535 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' B' ' 61' ' ' ASP . 0.4 OUTLIER -44.31 -37.65 3.42 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 0.0 109.363 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 179.29 32.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.0 109.675 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 93.44 1.71 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.52 -35.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.339 -1.095 . . . . 0.0 108.446 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 101.36 38.61 3.23 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.516 ' CB ' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -143.5 104.39 4.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -1.134 . . . . 0.0 109.425 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.521 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.6 t -69.69 156.54 38.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.858 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.472 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -115.46 171.61 7.61 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.483 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -59.03 -50.84 72.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.156 -0.965 . . . . 0.0 110.357 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.489 ' HB3' ' CE ' ' A' ' 79' ' ' MET . 0.9 OUTLIER -56.24 -39.4 72.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.254 -0.904 . . . . 0.0 109.161 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.472 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 1.1 mt-10 -79.59 -16.07 56.52 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.463 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.572 ' CZ ' HG13 ' B' ' 13' ' ' VAL . 54.3 t80 -69.46 -56.3 7.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.224 -0.922 . . . . 0.0 108.705 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.521 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 10.7 mtt -63.74 -49.32 73.48 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.441 ' HB1' ' HB3' ' A' ' 75' ' ' ALA . . . -59.44 -26.36 65.13 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.304 -0.872 . . . . 0.0 108.963 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.584 ' CD2' HG21 ' B' ' 77' ' ' VAL . 0.1 OUTLIER -64.6 -70.59 0.22 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.408 -0.807 . . . . 0.0 108.862 179.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.584 HG21 ' CD2' ' B' ' 76' ' ' PHE . 87.9 t -56.42 -20.61 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.25 -0.906 . . . . 0.0 108.958 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.536 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -64.25 -54.38 34.22 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.46 -0.775 . . . . 0.0 109.423 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.565 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 0.4 OUTLIER -68.24 -61.36 1.88 Allowed 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.345 -0.847 . . . . 0.0 109.652 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.52 ' CG1' HG13 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -48.43 -22.08 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.361 -1.462 . . . . 0.0 109.376 -179.402 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 3.6 m -79.23 -69.94 0.54 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.039 -1.038 . . . . 0.0 109.185 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.8 t -73.82 -49.17 26.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.063 -1.023 . . . . 0.0 109.227 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.565 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -36.55 -43.84 0.42 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.756 -0.59 . . . . 0.0 109.893 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.53 -50.33 71.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.469 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -10.12 49.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.295 -0.878 . . . . 0.0 109.53 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' B' ' 82' ' ' THR . 20.9 mt-10 -73.72 -19.02 60.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 109.539 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 24.3 t80 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.216 -0.928 . . . . 0.0 109.512 179.982 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.464 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.28 0.562 . . . . 0.0 109.487 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.525 ' HG3' ' CB ' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -64.05 -70.82 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.225 -0.922 . . . . 0.0 109.525 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.586 ' CD1' ' CD2' ' B' ' 10' ' ' LEU . 3.7 mm? -75.37 -32.5 60.85 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.464 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.0 OUTLIER -60.25 -60.29 4.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.272 -0.892 . . . . 0.0 109.559 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -63.07 -30.51 71.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -0.914 . . . . 0.0 109.507 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -75.4 -18.12 60.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.484 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.517 ' CG ' HD13 ' A' ' 11' ' ' ILE . 42.4 ttm -80.93 -48.88 11.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.459 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 42.5 t -68.29 -29.62 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 109.508 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -69.9 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.597 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.544 ' CD1' ' CD1' ' B' ' 10' ' ' LEU . 13.2 mt -46.0 -47.01 16.8 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 0.0 109.559 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.517 HD13 ' CG ' ' A' ' 7' ' ' MET . 12.3 mt -60.39 -41.16 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.933 . . . . 0.0 109.491 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.499 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 37.6 t0 -63.03 -21.4 66.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.493 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.572 HG13 ' CE1' ' A' ' 73' ' ' PHE . 2.3 t -84.11 -31.37 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.928 . . . . 0.0 109.391 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 15.1 t80 -68.0 -44.66 76.08 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.017 -1.052 . . . . 0.0 109.21 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.492 ' CD2' ' HD3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -80.83 -41.13 23.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.296 -0.877 . . . . 0.0 109.501 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.499 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 9.8 tt0 -60.16 -61.63 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.95 . . . . 0.0 109.443 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.581 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 32.7 m-85 -57.28 -50.66 72.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.524 ' CA ' HD22 ' A' ' 27' ' ' LEU . 38.1 t -61.24 -18.72 59.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.618 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.455 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -64.68 -31.8 82.1 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.417 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -70.3 -43.38 70.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.273 -1.134 . . . . 0.0 109.481 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 18' ' ' SER . 22.2 tp10 -97.06 135.04 39.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.263 -0.898 . . . . 0.0 109.442 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 52.85 -145.78 19.46 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 0.4 OUTLIER -80.38 -74.65 0.3 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -1.137 . . . . 0.0 109.491 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.492 ' HD3' ' CD2' ' A' ' 15' ' ' HIS . 0.0 OUTLIER 168.79 46.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 109.424 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.32 -14.72 7.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.0 109.695 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.522 ' CG ' ' HB3' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -149.04 170.08 19.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 0.0 109.613 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.524 HD22 ' CA ' ' A' ' 18' ' ' SER . 96.4 mt -118.01 127.08 53.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.776 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 30' ' ' SER . 4.3 tttp -69.81 152.89 44.05 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HG3' ' N ' ' A' ' 30' ' ' SER . 4.2 ptpt -37.14 -30.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.453 -0.779 . . . . 0.0 109.847 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.505 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.97 -50.9 15.11 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.247 -0.908 . . . . 0.0 109.38 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 2.1 mp0 -49.91 -43.81 49.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 108.905 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.515 ' CD2' ' HB2' ' A' ' 27' ' ' LEU . 31.3 mt -57.15 -66.82 0.39 Allowed 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.673 -0.642 . . . . 0.0 109.275 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.519 ' HD3' ' CD1' ' A' ' 47' ' ' ILE . 2.5 mttp -41.35 -31.35 0.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -0.835 . . . . 0.0 109.779 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -64.54 -68.61 0.34 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.18 -0.95 . . . . 0.0 109.35 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 3.1 mm? -44.04 -44.79 7.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.549 HG13 ' CZ ' ' A' ' 76' ' ' PHE . 1.5 mp -53.4 -48.09 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.202 -0.937 . . . . 0.0 109.631 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' C ' ' A' ' 38' ' ' ASN . 3.2 m120 -73.97 -67.26 0.62 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.111 -0.993 . . . . 0.0 110.055 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.441 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.5 OUTLIER -40.83 -70.49 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.442 -0.786 . . . . 0.0 110.269 -179.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.467 ' OE2' HG13 ' A' ' 77' ' ' VAL . 31.5 tt0 -67.59 -51.8 46.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.174 -0.954 . . . . 0.0 110.026 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ILE . 2.4 mp -98.15 65.85 1.76 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.199 -0.938 . . . . 0.0 109.572 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.321 -0.862 . . . . 0.0 109.606 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.519 ' CD1' ' HD3' ' A' ' 33' ' ' LYS . 1.5 mt . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -43.03 -27.15 0.18 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.3 -0.875 . . . . 0.0 109.562 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.52 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 1.5 mm-40 164.23 63.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.398 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 2.9 mm-40 51.62 48.82 22.15 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.253 -0.905 . . . . 0.0 109.329 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -87.49 -70.07 0.65 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.588 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.533 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 2.5 t -88.16 -22.42 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.226 -0.921 . . . . 0.0 109.601 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.518 ' CG2' HD12 ' A' ' 47' ' ' ILE . 78.8 t -78.9 -29.93 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.068 -1.02 . . . . 0.0 109.262 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 19.5 t0 -77.12 -49.31 15.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.272 -0.892 . . . . 0.0 109.221 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -50.35 51.37 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 57' ' ' MET . 1.9 p -58.43 -49.35 82.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.09 -1.007 . . . . 0.0 109.072 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.563 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 8.5 tpt -41.53 -44.31 2.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.79 . . . . 0.0 109.802 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 26.1 mt-10 -57.01 -48.19 79.06 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.23 -0.919 . . . . 0.0 109.424 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.526 HG23 ' CE ' ' A' ' 79' ' ' MET . 4.7 t -76.23 -9.7 58.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.278 -0.889 . . . . 0.0 109.977 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.543 ' CD2' ' HB2' ' A' ' 76' ' ' PHE . 16.7 mt -87.27 3.05 48.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.491 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 17.8 p-10 -85.46 114.59 22.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.17 -0.956 . . . . 0.0 109.47 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -52.45 -22.0 4.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.506 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 176.99 40.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.91 . . . . 0.0 109.472 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.419 ' O ' ' CG ' ' A' ' 65' ' ' ASP . . . 77.63 90.36 0.32 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 176.28 -32.46 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.277 -1.131 . . . . 0.0 108.579 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.12 -22.36 23.16 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.522 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mm-40 -70.01 106.94 3.4 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -1.115 . . . . 0.0 109.389 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 14.2 t -69.92 157.08 38.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 109.679 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.461 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 34.3 t0 -117.58 171.26 8.13 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -58.74 -50.3 74.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.468 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 2.3 mp0 -56.81 -40.22 75.57 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.819 . . . . 0.0 108.983 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 mt-10 -76.63 -17.15 59.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.428 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.572 ' CE1' HG13 ' A' ' 13' ' ' VAL . 26.4 t80 -71.54 -49.56 39.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.19 -0.944 . . . . 0.0 108.966 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.521 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 9.6 mmt -66.04 -54.31 27.45 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.312 -0.867 . . . . 0.0 109.034 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 79' ' ' MET . . . -60.63 -26.3 66.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.24 -0.913 . . . . 0.0 108.999 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.549 ' CZ ' HG13 ' A' ' 36' ' ' ILE . 0.4 OUTLIER -59.25 -68.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' A' ' 81' ' ' THR . 53.4 t -62.75 -20.53 25.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.552 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -69.19 -30.86 69.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.447 -0.783 . . . . 0.0 109.269 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 20.7 mtp -85.47 -67.53 0.8 Allowed 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.838 0.827 . . . . 0.0 109.072 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.533 ' CG1' ' HB ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.15 -22.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 O-C-N 120.4 -1.438 . . . . 0.0 109.505 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 45.2 m -85.15 -61.1 1.85 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.007 -1.058 . . . . 0.0 108.468 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.572 ' OG1' ' CD2' ' B' ' 70' ' ' PHE . 1.4 m -80.28 -55.27 5.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -35.32 -42.12 0.19 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.276 0.56 . . . . 0.0 109.933 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 87' ' ' PHE . 30.4 t -69.03 -58.88 3.51 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.912 . . . . 0.0 109.463 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.421 ' C ' ' O ' ' A' ' 84' ' ' CYS . 2.1 t60 -44.5 -64.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -49.12 -36.02 17.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.438 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.309 -0.869 . . . . 0.0 109.474 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.49 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 58.4 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.73 -74.9 0.08 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.291 -0.881 . . . . 0.0 109.488 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.508 ' CD1' HG23 ' A' ' 13' ' ' VAL . 3.3 mp -71.16 -28.08 64.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.941 . . . . 0.0 109.488 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.49 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 34.4 tt0 -58.13 -58.3 9.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.394 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -59.49 -50.97 71.85 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.88 . . . . 0.0 109.336 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -61.88 -14.78 37.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.447 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.462 ' HG3' ' OE2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -76.39 -53.64 7.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 2.7 t -62.62 -27.69 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.525 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -80.17 -69.86 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.586 ' CD2' ' CD1' ' A' ' 3' ' ' LEU . 12.1 mt -44.4 -53.17 7.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 109.487 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.632 ' CD1' ' CZ ' ' B' ' 70' ' ' PHE . 22.1 mm -55.61 -58.22 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 109.886 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -51.4 -19.92 1.56 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.034 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.575 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 1.0 OUTLIER -88.58 -36.28 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.034 -1.041 . . . . 0.0 109.595 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.537 ' CD1' ' HB2' ' B' ' 73' ' ' PHE . 27.3 t80 -58.86 -41.64 87.49 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.777 -1.202 . . . . 0.0 108.837 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' B' ' 16' ' ' GLN . 0.3 OUTLIER -80.7 -46.25 15.84 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.334 -0.853 . . . . 0.0 109.252 179.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' B' ' 15' ' ' HIS . 1.7 tt0 -44.72 -40.17 5.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 108.685 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.521 ' O ' ' N ' ' B' ' 19' ' ' GLY . 3.9 m-85 -91.36 -79.23 0.37 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' B' ' 25' ' ' HIS . 32.2 t 37.0 29.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.242 0.544 . . . . 0.0 110.042 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 74.79 51.78 7.66 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -63.49 -10.01 15.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.328 -1.101 . . . . 0.0 109.814 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -93.18 69.91 4.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.998 . . . . 0.0 109.382 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.92 -42.16 1.49 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.459 ' O ' ' O ' ' B' ' 19' ' ' GLY . 1.1 m-20 -141.36 -153.3 0.45 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -1.174 . . . . 0.0 109.455 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.431 ' C ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -176.75 43.13 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.541 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.47 ' N ' ' OG ' ' B' ' 18' ' ' SER . 0.7 OUTLIER -122.44 -16.61 7.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.264 -0.897 . . . . 0.0 109.688 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.07 170.21 7.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.263 -0.898 . . . . 0.0 109.349 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.531 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 12.6 mt -84.94 137.96 32.79 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 2.0 ptmt -109.67 73.12 0.83 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.225 -0.922 . . . . 0.0 109.504 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.462 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 2.4 tttm 61.54 -85.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.4 -0.813 . . . . 0.0 110.037 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 1.7 t -45.63 -39.43 7.75 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.134 -0.978 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.531 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 3.2 mm-40 -47.96 -50.12 28.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.94 -1.1 . . . . 0.0 108.745 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.631 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 1.1 mt -59.14 -55.76 30.89 Favored 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.53 ' CE ' HG13 ' B' ' 53' ' ' VAL . 7.7 mttp -42.56 -33.82 0.76 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.436 -0.79 . . . . 0.0 109.595 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -71.7 -66.14 0.67 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.683 -179.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.577 HD23 ' CE1' ' B' ' 73' ' ' PHE . 0.3 OUTLIER -41.98 -60.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.363 -0.835 . . . . 0.0 110.231 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.522 ' CD1' HG23 ' B' ' 80' ' ' VAL . 80.7 mt -57.4 -53.55 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.326 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.526 ' ND2' ' N ' ' B' ' 37' ' ' ASN . 0.7 OUTLIER -83.39 15.99 2.75 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.132 -0.98 . . . . 0.0 110.36 -179.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.527 ' N ' ' O ' ' B' ' 34' ' ' GLU . 22.6 t30 -135.7 4.28 3.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.523 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 4.7 mp0 -133.19 -37.31 0.98 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.101 -0.999 . . . . 0.0 109.49 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.516 ' CD1' ' HA ' ' B' ' 36' ' ' ILE . 5.4 mp -75.7 -54.71 6.53 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.15 -0.969 . . . . 0.0 109.407 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.465 0 O-C-N 121.293 -0.88 . . . . 0.0 109.223 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.528 HG22 HD11 ' B' ' 47' ' ' ILE . 1.6 mt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.6 ptpt -43.35 -32.48 0.83 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.522 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 4.0 pt-20 179.01 54.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.258 -0.901 . . . . 0.0 109.498 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.528 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 1.8 mt-30 48.45 53.8 11.46 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 55' ' ' LYS . 0.5 OUTLIER -90.21 -70.09 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.285 -0.884 . . . . 0.0 109.798 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.539 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 1.9 t -86.49 -20.2 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 109.75 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.53 HG13 ' CE ' ' B' ' 33' ' ' LYS . 25.4 t -80.71 -36.92 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.056 -1.027 . . . . 0.0 108.892 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.528 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 36.6 t70 -81.6 -28.84 33.55 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.009 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 0.9 OUTLIER -77.66 -43.32 31.7 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.339 -0.85 . . . . 0.0 109.238 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.525 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 15.8 m -57.04 -51.76 64.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 121.181 -0.949 . . . . 0.0 109.656 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.488 ' CE ' ' CD1' ' B' ' 32' ' ' LEU . 1.7 tpt -40.19 -28.42 0.06 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.116 -0.99 . . . . 0.0 109.752 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' B' ' 56' ' ' VAL . 3.7 mt-10 -77.91 -48.4 16.45 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.065 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.48 ' O ' ' C ' ' B' ' 60' ' ' LEU . 38.8 m -74.55 -63.16 1.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.292 -0.88 . . . . 0.0 109.354 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.624 ' CD2' ' CD1' ' B' ' 76' ' ' PHE . 10.5 mt -34.95 -36.81 0.06 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.298 0.57 . . . . 0.0 110.128 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' B' ' 59' ' ' THR . 10.3 t70 -81.89 73.58 8.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 -87.57 -27.04 22.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.88 . . . . 0.0 109.489 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -82.25 -51.5 7.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.902 . . . . 0.0 109.488 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.97 90.72 2.13 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -175.49 -35.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -1.146 . . . . 0.0 108.595 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.62 38.46 2.22 Favored Glycine 0 N--CA 1.485 1.964 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.487 ' HB3' ' NZ ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -153.63 108.06 3.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.315 -1.109 . . . . 0.0 109.493 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.535 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 75.1 m -69.64 156.06 39.54 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.342 -0.849 . . . . 0.0 109.898 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.443 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 8.5 m-20 -117.43 170.29 8.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.358 -0.839 . . . . 0.0 108.944 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.632 ' CZ ' ' CD1' ' B' ' 11' ' ' ILE . 0.1 OUTLIER -48.83 -67.43 0.27 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 111.319 -179.385 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.505 ' NE2' ' HG2' ' B' ' 72' ' ' GLU . 1.5 pp0? -44.21 -27.81 0.45 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.21 -0.931 . . . . 0.0 108.955 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.612 ' O ' ' CD1' ' B' ' 76' ' ' PHE . 4.6 mt-10 -77.38 -43.2 33.6 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.407 -0.808 . . . . 0.0 109.809 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.578 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 12.6 t80 -49.15 -49.18 43.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.925 -1.11 . . . . 0.0 108.988 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.552 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 6.4 mtt -64.0 -41.31 97.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.437 -0.789 . . . . 0.0 109.381 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' B' ' 79' ' ' MET . . . -66.42 -16.3 63.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.269 -0.894 . . . . 0.0 108.747 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.631 ' CD2' ' CD2' ' B' ' 32' ' ' LEU . 13.3 m-30 -75.5 -70.25 0.44 Allowed 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.501 ' O ' ' CB ' ' B' ' 81' ' ' THR . 39.4 t -52.64 -24.89 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.521 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -64.4 -48.04 76.91 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.37 -0.831 . . . . 0.0 109.36 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 67.0 mtp -74.74 -67.54 0.63 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -0.888 . . . . 0.0 109.841 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.539 ' CG1' ' HB ' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.99 -23.44 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 120.435 -1.416 . . . . 0.0 109.704 -178.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.501 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 7.8 m -80.28 -68.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.906 -1.121 . . . . 0.0 108.795 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.5 t -77.65 -49.33 14.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.179 -0.951 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.563 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.46 -37.1 0.18 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.261 0.553 . . . . 0.0 109.791 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 3.1 t -90.05 -35.34 15.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 0.0 109.505 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.0 OUTLIER -65.79 -9.99 33.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -70.68 -21.06 62.63 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 t80 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.249 -0.907 . . . . 0.0 109.504 179.994 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.517 ' HB3' ' CA ' ' B' ' 9' ' ' ALA . 3.8 mm-40 -70.22 -51.94 27.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.296 -0.878 . . . . 0.0 109.306 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.578 HD22 ' CZ ' ' B' ' 73' ' ' PHE . 2.0 mp -72.41 -29.45 63.74 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' A' ' 7' ' ' MET . 1.2 tt0 -58.74 -64.5 0.91 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.197 -0.939 . . . . 0.0 109.312 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -43.57 98.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.208 -0.932 . . . . 0.0 109.265 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.529 ' CB ' ' HA ' ' B' ' 6' ' ' ALA . . . -68.41 -9.99 52.19 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.448 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.506 ' CE ' HG13 ' B' ' 77' ' ' VAL . 0.0 OUTLIER -83.64 -52.71 6.22 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.917 . . . . 0.0 109.403 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.01 -20.36 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.862 . . . . 0.0 109.444 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.59 -60.21 2.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.213 -0.93 . . . . 0.0 109.639 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.488 ' CD2' HD22 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -54.7 -38.46 67.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.591 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.516 ' CD1' HG22 ' B' ' 81' ' ' THR . 36.6 mt -68.17 -57.71 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.566 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -56.49 -19.05 13.52 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.277 -0.889 . . . . 0.0 109.46 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.458 HG12 HD23 ' B' ' 3' ' ' LEU . 0.8 OUTLIER -88.38 -29.9 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.138 -0.977 . . . . 0.0 109.253 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 73' ' ' PHE . 6.0 t80 -66.2 -41.4 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.051 -1.03 . . . . 0.0 109.075 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.658 ' CE1' ' CD2' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -78.46 -43.42 27.21 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.884 . . . . 0.0 109.388 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.63 -55.65 20.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -0.925 . . . . 0.0 109.447 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.562 ' CD2' HD21 ' A' ' 35' ' ' LEU . 20.9 m-85 -60.4 -43.75 96.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 109.532 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.511 ' OG ' ' N ' ' A' ' 25' ' ' HIS . 5.5 p -56.92 -22.12 35.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.47 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.446 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -71.23 -35.93 63.78 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 19' ' ' GLY . 42.0 mmm-85 -43.96 -47.14 8.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -1.108 . . . . 0.0 109.464 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' A' ' 22' ' ' GLY . 3.4 tm-20 -70.42 154.67 41.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.461 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.23 -26.41 0.92 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.67 -149.8 0.18 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -174.26 65.6 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.275 -0.891 . . . . 0.0 109.425 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.658 ' CD2' ' CE1' ' A' ' 15' ' ' HIS . 7.3 m80 -169.28 -35.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.576 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.496 ' N ' ' HB2' ' A' ' 18' ' ' SER . 22.6 mtmt -129.34 159.6 35.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -0.906 . . . . 0.0 109.492 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.472 ' HB3' ' HB2' ' A' ' 31' ' ' GLU . 7.3 mp -95.2 167.11 11.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 109.454 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -134.39 79.95 1.83 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.552 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 4.1 ttmt 61.81 -85.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 110.3 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.428 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 6.8 m -44.68 -49.65 10.3 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 0.0 110.435 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 63.9 mm-40 -63.11 -34.46 77.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.029 -1.045 . . . . 0.0 109.716 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.545 ' CD2' ' CD1' ' A' ' 60' ' ' LEU . 1.9 mp -61.37 -70.19 0.2 Allowed 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.434 -0.791 . . . . 0.0 109.674 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 9.1 ttmt -42.43 -39.28 2.16 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.332 -0.855 . . . . 0.0 109.75 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -58.7 -56.64 19.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.58 ' HG ' ' CZ ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -46.85 -35.27 6.16 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 109.476 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.62 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 1.2 mp -72.31 -39.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.592 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 57.0 m-80 -78.66 -1.75 35.86 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.185 -0.947 . . . . 0.0 109.809 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.513 ' ND2' ' OH ' ' A' ' 17' ' ' TYR . 21.0 t-20 -107.45 -25.02 11.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.593 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' B' ' 3' ' ' LEU . 3.1 tm-20 -99.42 -44.97 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -0.929 . . . . 0.0 109.505 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.526 ' CD1' ' HA ' ' A' ' 81' ' ' THR . 3.6 mm? -56.11 -44.92 79.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.217 -0.927 . . . . 0.0 109.407 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.509 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.545 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.529 ' CD1' HG22 ' A' ' 53' ' ' VAL . 3.9 mp . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.3 0.571 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 pttt -149.57 -48.7 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.474 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.489 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 87.9 mt-10 -64.81 -10.84 31.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.365 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.489 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 0.8 OUTLIER 75.29 54.28 0.07 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.292 -0.88 . . . . 0.0 109.448 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.83 -70.4 0.68 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.251 -0.906 . . . . 0.0 109.606 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.54 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 2.2 t -92.03 -24.78 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.112 -0.993 . . . . 0.0 109.251 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.529 HG22 ' CD1' ' A' ' 47' ' ' ILE . 39.2 t -78.58 -18.57 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.0 109.36 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.6 t0 -87.69 -37.67 16.5 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.239 -0.913 . . . . 0.0 109.44 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -78.81 -39.21 36.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.54 ' CG2' ' O ' ' A' ' 52' ' ' VAL . 34.0 m -65.08 -46.16 92.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.507 ' CE ' HD23 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -43.51 -25.74 0.17 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.117 -0.989 . . . . 0.0 110.144 -179.6 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.8 OUTLIER -86.39 -47.15 9.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.074 -1.016 . . . . 0.0 109.892 -179.632 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.528 HG23 ' CE ' ' A' ' 79' ' ' MET . 7.2 t -68.98 -9.76 53.92 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.226 -0.921 . . . . 0.0 109.828 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.561 HD23 ' CG ' ' A' ' 76' ' ' PHE . 6.7 mt -94.4 -68.57 0.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.504 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 57' ' ' MET . 49.7 p-10 -65.03 87.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.495 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -82.94 -9.34 59.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.15 -22.43 16.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.235 -0.916 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 79.9 69.14 1.42 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 26.6 t70 178.36 32.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.287 -1.125 . . . . 0.0 108.374 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.43 64.89 3.08 Favored Glycine 0 N--CA 1.482 1.721 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.467 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 6.0 mt-10 -143.9 84.81 1.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.317 -1.108 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 69' ' ' ASP . 16.0 t -69.95 157.08 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 109.724 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.474 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.2 OUTLIER -117.84 171.85 7.78 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.753 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HA ' ' CE2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -59.33 -51.35 70.3 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.248 -0.907 . . . . 0.0 110.412 -179.601 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.464 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 17.6 pt20 -57.27 -40.32 77.46 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.229 -0.92 . . . . 0.0 108.802 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mt-10 -77.36 -16.17 59.02 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.467 -0.77 . . . . 0.0 109.349 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 14' ' ' PHE . 56.9 t80 -70.38 -64.19 0.94 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.526 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 2.7 tpp -58.11 -43.38 87.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.475 ' HB1' ' CB ' ' B' ' 75' ' ' ALA . . . -63.2 -28.03 69.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.439 -0.788 . . . . 0.0 109.126 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.62 ' CZ ' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -62.34 -69.8 0.24 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 108.797 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.3 t -57.07 -22.78 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.529 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -57.69 -52.76 64.1 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.508 -0.745 . . . . 0.0 109.418 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.575 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.7 OUTLIER -73.94 -63.26 1.25 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.436 -0.79 . . . . 0.0 109.923 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.589 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -47.88 -22.14 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 O-C-N 120.314 -1.492 . . . . 0.0 109.378 -179.14 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.526 ' HA ' ' CD1' ' A' ' 40' ' ' LEU . 4.5 m -79.1 -67.77 0.72 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.01 -1.056 . . . . 0.0 108.863 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.57 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -79.43 -49.43 12.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.135 -0.978 . . . . 0.0 108.837 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.575 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -37.85 -34.88 0.12 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.678 -0.639 . . . . 0.0 109.694 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 30.7 t -82.31 -46.13 14.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.493 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -47.03 -25.11 0.75 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.232 -0.918 . . . . 0.0 109.49 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.55 -50.7 13.26 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 0.0 109.508 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.183 -0.948 . . . . 0.0 109.54 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.456 ' O ' ' HB1' ' B' ' 6' ' ' ALA . 0.8 OUTLIER -64.37 -78.66 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.894 . . . . 0.0 109.769 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.518 ' HB3' ' CB ' ' A' ' 39' ' ' GLU . 90.0 mt -63.01 -25.24 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.126 -0.983 . . . . 0.0 109.892 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.52 ' O ' ' CG ' ' B' ' 7' ' ' MET . 1.0 OUTLIER -69.8 -70.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.127 -0.983 . . . . 0.0 109.537 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.456 ' O ' ' HB1' ' B' ' 9' ' ' ALA . 13.6 tttt -60.28 -17.7 44.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 109.466 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.529 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -85.79 -26.81 25.57 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -0.921 . . . . 0.0 109.765 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.522 ' HG3' ' N ' ' B' ' 8' ' ' VAL . 3.4 ptt? -78.87 -31.74 45.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.128 -0.983 . . . . 0.0 109.474 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.522 ' N ' ' HG3' ' B' ' 7' ' ' MET . 56.0 t -82.39 -39.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.202 -0.936 . . . . 0.0 109.386 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.517 ' CA ' ' HB3' ' A' ' 2' ' ' GLU . . . -66.85 -42.95 84.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.24 -0.913 . . . . 0.0 109.41 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.574 ' HG ' ' CE2' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -68.65 -62.56 1.33 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.406 ' C ' ' O ' ' B' ' 10' ' ' LEU . 85.7 mt -44.98 -41.75 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.181 -0.95 . . . . 0.0 109.209 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.515 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 23.0 t0 -58.83 -61.81 2.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.311 -0.868 . . . . 0.0 109.364 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.559 ' CG1' ' CZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -44.54 -25.45 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.337 -0.852 . . . . 0.0 109.434 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 4.3 t80 -72.32 -49.69 32.54 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.927 -1.108 . . . . 0.0 109.344 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -75.91 -9.99 59.06 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 110.013 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.515 ' CG ' ' O ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -90.2 -61.69 1.63 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.047 -1.033 . . . . 0.0 109.319 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.577 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 34.2 m-85 -57.98 -43.77 86.71 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.573 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.52 ' CA ' HD22 ' B' ' 27' ' ' LEU . 2.7 p -74.64 -14.01 60.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.508 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.522 ' CA ' ' HG2' ' B' ' 24' ' ' LYS . . . -92.54 8.98 76.65 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.493 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 54.7 mtp85 -87.81 -59.88 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -1.15 . . . . 0.0 109.396 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.2 OUTLIER -80.33 170.11 16.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.298 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' B' ' 23' ' ' ASP . . . -52.01 89.46 0.01 OUTLIER Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' B' ' 22' ' ' GLY . 0.5 OUTLIER 162.39 -164.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -1.084 . . . . 0.0 109.365 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.522 ' HG2' ' CA ' ' B' ' 19' ' ' GLY . 0.0 OUTLIER 171.05 58.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.236 -0.915 . . . . 0.0 109.458 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 16.5 t60 -170.27 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.302 -0.874 . . . . 0.0 109.643 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.524 ' CE ' ' HB3' ' B' ' 67' ' ' GLU . 1.4 ptmt -127.03 166.03 18.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.202 -0.936 . . . . 0.0 109.574 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.532 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 20.7 mt -121.16 130.62 53.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.265 -0.897 . . . . 0.0 109.859 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' B' ' 29' ' ' LYS . 5.0 ttpt -69.6 155.54 40.33 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -39.98 -38.68 0.74 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.185 -0.947 . . . . 0.0 109.732 -179.464 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.33 -46.15 71.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.324 -0.86 . . . . 0.0 109.582 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.532 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -53.03 -44.62 67.5 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.021 -1.049 . . . . 0.0 108.352 179.62 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.545 ' CD1' HD21 ' B' ' 60' ' ' LEU . 3.6 mm? -51.78 -70.71 0.08 Allowed 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.527 ' CA ' HG13 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -37.28 -33.11 0.05 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.731 -0.606 . . . . 0.0 110.146 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.448 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -69.84 -61.03 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.137 -0.977 . . . . 0.0 109.635 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.577 ' HG ' ' CZ ' ' B' ' 17' ' ' TYR . 0.7 OUTLIER -53.04 -20.6 3.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.332 -0.855 . . . . 0.0 110.052 -179.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.579 HD12 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -82.42 -49.06 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.047 -1.033 . . . . 0.0 109.391 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.77 0.05 19.31 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.182 -0.949 . . . . 0.0 109.462 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.44 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 0.6 OUTLIER -118.73 -22.33 7.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.163 -0.96 . . . . 0.0 109.576 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.59 ' CG ' ' CD2' ' B' ' 40' ' ' LEU . 18.5 pt-20 -91.59 -45.07 8.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.59 ' CD2' ' CG ' ' B' ' 39' ' ' GLU . 0.8 OUTLIER -84.19 -50.6 7.75 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 108.616 179.348 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.423 ' OG ' ' C ' ' B' ' 40' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.591 -0.693 . . . . 0.0 109.657 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.531 HG22 ' CG2' ' B' ' 53' ' ' VAL . 12.0 mt . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 121.248 0.547 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.2 pttt -44.85 -27.38 0.51 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.215 -0.928 . . . . 0.0 108.819 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' B' ' 48' ' ' LYS . 10.5 pt-20 178.08 -32.23 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.495 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -165.05 28.02 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.388 -0.82 . . . . 0.0 109.251 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -69.16 -70.77 0.25 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.43 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 2.4 t -91.03 -9.89 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.11 -0.994 . . . . 0.0 109.009 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.531 ' CG2' HG22 ' B' ' 47' ' ' ILE . 10.6 t -84.85 -29.67 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.495 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 17.9 t0 -90.15 -28.88 18.64 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -84.93 -49.81 8.03 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.442 -0.786 . . . . 0.0 109.105 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.538 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 0.8 OUTLIER -63.06 -41.52 93.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.132 -0.98 . . . . 0.0 108.754 179.578 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' B' ' 53' ' ' VAL . 0.9 OUTLIER -43.06 -46.09 5.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.481 -0.762 . . . . 0.0 109.238 179.605 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -60.66 -48.25 82.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.227 -0.92 . . . . 0.0 109.009 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.435 ' O ' HG21 ' B' ' 59' ' ' THR . 4.0 m -64.36 -13.95 53.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.352 -0.843 . . . . 0.0 109.196 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.545 HD21 ' CD1' ' B' ' 32' ' ' LEU . 2.6 mp -92.25 -81.41 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.336 -0.853 . . . . 0.0 109.494 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' B' ' 57' ' ' MET . 46.1 p-10 -59.17 89.17 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' B' ' 60' ' ' LEU . 0.2 OUTLIER -103.01 -1.66 28.9 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.621 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . 0.427 ' HB2' ' OE2' ' B' ' 67' ' ' GLU . 0.7 OUTLIER -81.54 -9.34 59.71 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.118 -0.989 . . . . 0.0 109.488 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.39 81.85 0.43 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.72 -32.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.242 -1.152 . . . . 0.0 108.635 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.08 37.34 1.84 Allowed Glycine 0 N--CA 1.486 1.981 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.524 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -129.61 149.25 51.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.258 -1.142 . . . . 0.0 109.467 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 10.2 t -95.58 155.61 16.67 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.699 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.465 ' HB3' ' HG2' ' B' ' 72' ' ' GLU . 17.2 t70 -121.39 171.18 8.95 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.453 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.1 OUTLIER -60.26 -54.29 47.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.135 -0.978 . . . . 0.0 110.334 -179.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.507 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 1.9 pt20 -56.55 -21.72 28.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.086 -1.009 . . . . 0.0 108.815 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' B' ' 76' ' ' PHE . 14.9 mm-40 -84.61 -30.46 24.94 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.559 -0.713 . . . . 0.0 109.159 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.578 ' CZ ' HD22 ' A' ' 3' ' ' LEU . 37.1 t80 -62.85 -47.03 85.14 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.407 -0.808 . . . . 0.0 109.083 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.529 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 3.1 mtt -70.33 -56.63 6.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.348 -0.845 . . . . 0.0 109.301 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.475 ' CB ' ' HB1' ' A' ' 75' ' ' ALA . . . -59.43 -16.08 21.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 108.928 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.579 ' CE1' HD12 ' B' ' 36' ' ' ILE . 2.5 t80 -72.49 -68.99 0.43 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.512 -0.742 . . . . 0.0 109.137 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.506 HG13 ' CE ' ' A' ' 7' ' ' MET . 42.7 t -56.1 -27.92 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.259 -0.901 . . . . 0.0 109.162 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.526 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -67.16 -36.46 81.85 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.378 -0.826 . . . . 0.0 109.5 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.538 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 0.0 OUTLIER -77.08 -68.16 0.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 109.557 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.568 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -46.41 -24.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 O-C-N 120.606 -1.309 . . . . 0.0 109.068 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.516 HG22 ' CD1' ' A' ' 11' ' ' ILE . 8.8 m -76.77 -69.19 0.53 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.142 -0.974 . . . . 0.0 109.395 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.4 t -75.34 -49.55 18.76 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.04 -1.037 . . . . 0.0 108.922 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.574 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.38 -30.33 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.761 -0.587 . . . . 0.0 109.775 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' B' ' 82' ' ' THR . 15.7 t -81.4 -46.65 14.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.304 -0.872 . . . . 0.0 109.604 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.0 OUTLIER -67.36 -9.85 45.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -83.99 -15.78 46.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 109.598 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.892 . . . . 0.0 109.605 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.277 0.56 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.526 ' HB3' ' CB ' ' B' ' 9' ' ' ALA . 2.9 mm-40 -68.76 -48.94 62.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.241 -0.912 . . . . 0.0 109.272 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.585 ' CD1' ' CD2' ' B' ' 35' ' ' LEU . 5.5 mt -78.99 -23.3 44.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.31 -0.869 . . . . 0.0 109.423 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.71 -61.99 2.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.127 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.44 -41.72 96.4 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.292 -0.88 . . . . 0.0 109.183 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.518 ' HB3' ' CB ' ' B' ' 6' ' ' ALA . . . -70.94 -10.77 60.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.385 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 3' ' ' LEU . 2.7 mtp -82.07 -54.84 4.97 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.197 -0.939 . . . . 0.0 109.289 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -32.76 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.328 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.46 ' HB3' ' HG2' ' B' ' 2' ' ' GLU . . . -73.17 -65.9 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.272 -0.892 . . . . 0.0 109.527 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.7 mt -44.47 -34.53 2.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.207 -0.933 . . . . 0.0 109.335 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.39 -52.24 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.921 . . . . 0.0 109.361 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.53 -19.81 40.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.229 -0.919 . . . . 0.0 109.222 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.574 HG13 ' CZ ' ' A' ' 73' ' ' PHE . 1.3 t -83.4 -29.78 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.338 -0.851 . . . . 0.0 109.333 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 46.7 t80 -70.5 -42.71 70.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.918 -1.114 . . . . 0.0 109.138 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.33 -34.12 36.93 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.31 -0.869 . . . . 0.0 109.492 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.21 -62.13 1.58 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.206 -0.934 . . . . 0.0 109.445 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.576 ' CD1' HD22 ' A' ' 35' ' ' LEU . 28.2 m-85 -56.6 -47.22 80.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.304 -0.873 . . . . 0.0 109.413 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.513 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 4.6 p -70.0 -17.56 63.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.478 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.468 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -91.26 15.31 61.47 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.1 mmt85 -89.61 -43.19 10.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.25 -1.147 . . . . 0.0 109.483 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 20' ' ' ARG . 7.0 mt-10 -164.9 119.73 1.35 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.252 -0.905 . . . . 0.0 109.47 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 -117.3 1.09 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 22.4 m-20 -115.48 -2.99 12.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -1.161 . . . . 0.0 109.671 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 0.6 OUTLIER 76.25 17.7 2.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 109.502 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -142.04 10.82 1.97 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 109.482 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -170.14 167.36 8.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.196 -0.94 . . . . 0.0 109.499 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD21 ' N ' ' A' ' 32' ' ' LEU . 6.3 mp -100.31 164.78 11.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -0.932 . . . . 0.0 109.442 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 1.7 ptmm? -128.4 74.85 1.58 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.25 -0.906 . . . . 0.0 109.479 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 11.4 ttmt 61.83 -85.57 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.395 -0.816 . . . . 0.0 110.206 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.466 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -44.8 -48.41 10.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 78.5 mm-40 -56.02 -40.55 73.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 109.302 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.56 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 38.8 mt -60.06 -69.97 0.19 Allowed 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.633 -0.667 . . . . 0.0 109.571 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 37' ' ' ASN . 14.2 ttmt -42.54 -27.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.318 -0.864 . . . . 0.0 109.729 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' N ' ' OE1' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -66.54 -54.32 25.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 109.469 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.576 HD22 ' CD1' ' A' ' 17' ' ' TYR . 16.1 mt -53.49 -37.49 62.78 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.676 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.633 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 3.1 mm -69.0 -38.7 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.553 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 33' ' ' LYS . 7.2 m120 -82.88 -6.63 59.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 109.661 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.422 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -99.69 -18.24 17.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.514 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.525 ' OE1' ' CG1' ' A' ' 77' ' ' VAL . 19.6 tt0 -111.04 -57.57 2.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.229 -0.919 . . . . 0.0 109.544 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.52 ' O ' ' CB ' ' A' ' 41' ' ' SER . 6.3 mp -65.5 -53.69 38.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.267 -0.896 . . . . 0.0 109.52 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.336 -0.853 . . . . 0.0 109.329 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.528 ' CD1' HG13 ' A' ' 80' ' ' VAL . 1.6 mt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER -40.78 -25.81 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.434 -0.791 . . . . 0.0 109.678 -179.754 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -95.64 41.7 1.1 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.211 179.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.45 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 10.0 mt-30 45.9 48.12 12.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.899 . . . . 0.0 109.515 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -90.14 -70.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.288 -0.883 . . . . 0.0 109.536 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.544 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 1.7 t -92.37 -15.58 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.199 -0.938 . . . . 0.0 109.168 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.515 ' CG2' HG21 ' A' ' 47' ' ' ILE . 42.5 t -81.71 -23.57 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 108.896 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 1.1 t0 -86.19 -30.26 22.56 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.32 -0.862 . . . . 0.0 109.085 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -82.65 -46.15 13.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 0.0 109.217 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.53 ' CG2' ' O ' ' A' ' 52' ' ' VAL . 35.3 m -58.37 -43.79 87.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.181 -0.949 . . . . 0.0 109.544 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.454 ' O ' ' SD ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -48.2 -28.47 3.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.086 -1.009 . . . . 0.0 109.99 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.536 ' HG3' ' N ' ' A' ' 59' ' ' THR . 1.2 pp20? -82.58 -34.64 27.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.043 -1.036 . . . . 0.0 109.719 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.536 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 16.9 m -78.31 -64.84 1.07 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.177 -0.952 . . . . 0.0 109.267 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.646 ' CD2' ' CG ' ' A' ' 76' ' ' PHE . 8.8 mp -39.41 -31.6 0.09 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.608 -0.682 . . . . 0.0 109.791 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' THR . 0.4 OUTLIER -43.96 105.84 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 61' ' ' ASP . 18.9 t-20 -44.93 -48.53 11.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -178.61 31.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.245 -0.91 . . . . 0.0 109.575 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.02 90.78 1.54 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -175.82 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.286 -1.126 . . . . 0.0 108.509 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.24 27.21 6.62 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.513 ' HB2' ' CG ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -138.13 119.07 14.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.256 -1.143 . . . . 0.0 109.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.0 t -69.89 158.61 35.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.215 -0.928 . . . . 0.0 109.782 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.526 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.75 172.12 7.58 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 1.5 t80 -60.16 -56.2 24.51 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.885 . . . . 0.0 110.585 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.538 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 1.6 mp0 -57.27 -31.18 65.34 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.886 . . . . 0.0 109.275 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.526 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 0.1 OUTLIER -79.18 -23.9 43.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.392 -0.817 . . . . 0.0 108.986 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.574 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 1.9 t80 -65.34 -58.04 6.9 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.416 -0.802 . . . . 0.0 108.952 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.527 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.24 -41.57 93.44 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.26 -0.9 . . . . 0.0 109.028 179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' B' ' 75' ' ' ALA . . . -63.44 -26.07 68.56 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.081 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.646 ' CG ' ' CD2' ' A' ' 60' ' ' LEU . 2.1 t80 -67.79 -63.59 1.03 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.352 -0.843 . . . . 0.0 109.31 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.525 ' CG1' ' OE1' ' A' ' 39' ' ' GLU . 25.3 t -58.9 -25.42 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.315 -0.866 . . . . 0.0 108.963 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.538 ' HB1' ' CB ' ' B' ' 74' ' ' MET . . . -68.27 -33.4 74.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.43 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 83' ' ' ALA . 0.6 OUTLIER -81.7 -68.11 0.72 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -49.08 -21.01 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 O-C-N 120.546 -1.346 . . . . 0.0 110.114 -178.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.549 ' CG2' ' N ' ' A' ' 82' ' ' THR . 5.8 t -87.61 -49.73 6.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.675 -1.265 . . . . 0.0 108.901 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.595 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.1 m -90.57 -56.39 3.22 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -33.73 -34.16 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.313 0.578 . . . . 0.0 109.913 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.51 ' N ' ' O ' ' A' ' 82' ' ' THR . 41.0 t -79.03 -50.17 11.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.227 -0.921 . . . . 0.0 109.529 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.0 OUTLIER -53.78 -56.74 14.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.263 -0.898 . . . . 0.0 109.512 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.94 -19.76 61.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.562 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.0 t80 . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -179.985 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.526 ' OE1' ' CG2' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -63.86 -72.2 0.15 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.587 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.52 ' CB ' ' HG3' ' A' ' 39' ' ' GLU . 0.7 OUTLIER -62.33 -23.13 66.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.335 -0.853 . . . . 0.0 109.696 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.56 -62.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.443 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -26.82 68.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.208 -0.933 . . . . 0.0 109.27 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.518 ' CB ' ' HB3' ' A' ' 6' ' ' ALA . . . -74.93 -23.6 58.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 109.429 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -37.75 36.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.266 -0.896 . . . . 0.0 109.466 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.47 ' O ' HG21 ' B' ' 11' ' ' ILE . 74.8 t -71.07 -35.61 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.26 -0.9 . . . . 0.0 109.642 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' HB3' ' A' ' 2' ' ' GLU . . . -78.21 -56.66 4.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.184 -0.948 . . . . 0.0 109.564 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.567 HD21 ' CZ ' ' B' ' 73' ' ' PHE . 3.5 mt -54.29 -47.03 72.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 109.595 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.541 ' CG2' ' N ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -58.22 -46.89 88.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.137 -0.977 . . . . 0.0 109.425 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.541 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 2.6 m-20 -58.91 -22.74 60.24 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.138 -0.976 . . . . 0.0 109.492 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.57 HG12 ' CD1' ' B' ' 17' ' ' TYR . 1.1 t -85.56 -29.98 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.504 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 49.3 t80 -66.5 -42.24 87.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.798 -1.189 . . . . 0.0 109.246 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -76.83 -41.32 44.7 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -0.917 . . . . 0.0 109.534 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.62 -65.91 0.62 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 0.0 109.516 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.57 ' CD1' HG12 ' B' ' 13' ' ' VAL . 33.0 m-85 -50.75 -41.7 56.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 109.379 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.512 ' HB3' ' N ' ' B' ' 26' ' ' LYS . 1.4 m -88.32 43.05 1.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.276 -0.89 . . . . 0.0 109.468 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.14 -61.05 0.67 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -50.96 -20.62 1.41 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.377 -1.072 . . . . 0.0 110.005 -179.604 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.5 tm-20 -69.68 155.14 40.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.087 -1.008 . . . . 0.0 109.421 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . -43.2 -91.79 0.01 OUTLIER Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.306 -1.518 . . . . 0.0 109.306 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.531 ' O ' ' N ' ' B' ' 25' ' ' HIS . 1.5 m-20 -68.31 86.99 0.29 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.223 -1.163 . . . . 0.0 108.948 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' B' ' 18' ' ' SER . 8.6 pttp -41.97 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.451 -0.781 . . . . 0.0 109.829 -179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 23' ' ' ASP . 1.0 OUTLIER -170.46 -35.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.244 -0.91 . . . . 0.0 109.706 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -128.25 164.63 22.15 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.766 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.544 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 7.5 mp -90.56 164.55 14.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.34 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.488 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -131.32 74.35 1.59 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.325 -0.86 . . . . 0.0 109.346 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER 63.54 -83.21 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.607 -0.683 . . . . 0.0 110.363 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.465 ' O ' ' OE1' ' B' ' 34' ' ' GLU . 1.4 t -45.02 -44.55 10.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.147 -0.97 . . . . 0.0 110.591 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.544 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 19.9 mm-40 -61.87 -39.32 91.5 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.76 -1.213 . . . . 0.0 108.718 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.528 HD22 ' CB ' ' B' ' 27' ' ' LEU . 28.9 mt -55.35 -70.31 0.11 Allowed 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.525 ' CG ' HG12 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -44.45 -28.12 0.53 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.885 . . . . 0.0 109.731 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -67.72 -68.36 0.39 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.126 -0.984 . . . . 0.0 109.558 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.585 ' CD2' ' CD1' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -41.72 -49.32 4.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.389 -0.819 . . . . 0.0 109.862 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.577 HD13 ' CZ ' ' B' ' 76' ' ' PHE . 6.4 mm -56.0 -58.79 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.155 -0.965 . . . . 0.0 109.567 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.523 ' OD1' ' CG1' ' B' ' 47' ' ' ILE . 0.7 OUTLIER -85.06 15.19 4.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.0 109.844 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' B' ' 34' ' ' GLU . 5.2 m-20 -116.63 -8.97 11.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.473 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.524 ' HG2' ' CG ' ' A' ' 3' ' ' LEU . 12.5 mp0 -133.78 -44.38 0.81 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.534 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.8 mm? -56.49 -62.7 1.55 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.212 -0.93 . . . . 0.0 109.202 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.699 . . . . 0.0 110.62 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.528 ' CD1' HG22 ' B' ' 53' ' ' VAL . 1.5 mm . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.485 ' CE ' ' OE2' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -43.38 -48.2 6.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.478 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -158.51 58.09 0.45 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.231 -0.918 . . . . 0.0 109.278 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.46 ' O ' ' CB ' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 62.35 36.23 14.58 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.257 -0.902 . . . . 0.0 109.294 -179.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' B' ' 48' ' ' LYS . 3.1 tt0 -65.18 -70.14 0.25 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.338 -0.851 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.542 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 2.5 t -88.57 -15.67 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.221 -0.925 . . . . 0.0 109.414 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.528 HG22 ' CD1' ' B' ' 47' ' ' ILE . 52.3 t -78.93 -30.38 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.087 -1.008 . . . . 0.0 108.927 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' B' ' 50' ' ' GLN . 21.0 t0 -82.82 -36.86 25.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.291 -0.881 . . . . 0.0 109.069 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -72.01 -47.43 51.98 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 0.0 109.208 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.576 ' CG2' ' CZ ' ' B' ' 76' ' ' PHE . 33.9 m -59.84 -45.73 94.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 O-C-N 121.252 -0.905 . . . . 0.0 109.391 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.444 ' O ' ' SD ' ' B' ' 57' ' ' MET . 0.0 OUTLIER -43.22 -24.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.878 -1.139 . . . . 0.0 109.977 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.8 tt0 -88.29 -45.86 9.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.11 -0.993 . . . . 0.0 110.377 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.485 HG21 ' O ' ' B' ' 56' ' ' VAL . 8.5 t -69.82 -52.91 21.0 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.913 -1.117 . . . . 0.0 110.003 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.582 HD12 ' CE2' ' B' ' 76' ' ' PHE . 5.6 mt -44.81 -65.27 0.55 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.986 -1.071 . . . . 0.0 109.093 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.408 ' OD2' ' HA2' ' B' ' 66' ' ' GLY . 43.1 t0 -45.55 102.61 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 109.496 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.54 11.06 7.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' B' ' 65' ' ' ASP . 3.4 p30 -111.39 -13.69 13.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 109.438 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.89 77.34 1.0 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.411 ' HB2' ' OD1' ' B' ' 63' ' ' ASP . 0.4 OUTLIER 178.14 -33.24 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.222 -1.163 . . . . 0.0 108.632 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.408 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.19 4.66 29.04 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.46 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 2.3 mm-40 -98.15 137.81 36.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -1.177 . . . . 0.0 109.446 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.5 t -79.33 159.21 27.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.169 -0.957 . . . . 0.0 109.639 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.503 ' CB ' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -125.69 171.51 10.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.378 -0.826 . . . . 0.0 108.82 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.8 OUTLIER -58.03 -53.31 59.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.224 -0.923 . . . . 0.0 110.27 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.529 ' HG2' ' CG ' ' A' ' 79' ' ' MET . 8.5 mt-30 -58.16 -30.36 66.32 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.358 -0.839 . . . . 0.0 109.025 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.503 ' HG3' ' CB ' ' B' ' 69' ' ' ASP . 6.2 mt-10 -80.44 -22.02 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.433 -0.792 . . . . 0.0 109.278 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.567 ' CZ ' HD21 ' B' ' 10' ' ' LEU . 2.8 t80 -69.26 -61.77 1.65 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.286 -0.884 . . . . 0.0 108.795 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.538 ' CB ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -57.9 -42.51 84.85 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.52 ' HB3' ' CB ' ' A' ' 75' ' ' ALA . . . -61.85 -28.79 69.74 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.582 ' CE2' HD12 ' B' ' 60' ' ' LEU . 0.7 OUTLIER -64.31 -69.64 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.442 -0.786 . . . . 0.0 108.985 179.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' B' ' 81' ' ' THR . 43.1 t -51.93 -26.55 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.307 -0.87 . . . . 0.0 108.804 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.538 ' CB ' ' HA ' ' A' ' 71' ' ' GLN . . . -65.93 -42.97 89.4 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.37 -0.831 . . . . 0.0 109.432 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 26.2 mtm -77.89 -69.56 0.54 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.266 -0.896 . . . . 0.0 109.568 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.542 ' CG1' ' HB ' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.69 -24.15 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 O-C-N 120.683 -1.261 . . . . 0.0 110.026 -178.795 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 23.0 m -82.52 -65.69 0.98 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.854 -1.154 . . . . 0.0 108.594 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.1 m -75.59 -54.58 6.77 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.553 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -34.89 -46.74 0.32 Allowed 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.213 0.53 . . . . 0.0 110.186 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 54.0 t -64.71 -49.74 69.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.213 -0.929 . . . . 0.0 109.585 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -16.88 35.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.892 . . . . 0.0 109.548 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -90.1 -27.02 19.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.926 . . . . 0.0 109.504 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.546 -179.988 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.462 ' HB3' ' CB ' ' B' ' 9' ' ' ALA . 3.8 mm-40 -69.71 -60.87 2.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.307 -0.871 . . . . 0.0 109.438 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -66.32 -21.67 66.26 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.293 -0.88 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 7' ' ' MET . 25.9 mm-40 -63.99 -67.08 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.288 -0.882 . . . . 0.0 109.26 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 8' ' ' VAL . 10.1 mmtt -59.53 -44.89 93.07 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.212 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.53 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -62.86 -20.94 65.6 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.31 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.467 ' O ' HD11 ' A' ' 11' ' ' ILE . 59.5 ttp -72.9 -53.03 12.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.314 -0.866 . . . . 0.0 109.334 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -64.15 -20.86 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.202 -0.937 . . . . 0.0 109.41 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.504 ' CB ' ' HB3' ' B' ' 2' ' ' GLU . . . -80.84 -69.99 0.56 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 109.748 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.526 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.3 OUTLIER -50.64 -48.54 58.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.65 -179.802 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 1.2 mp -58.58 -50.23 79.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.158 -0.964 . . . . 0.0 109.101 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 45.0 t0 -60.53 -19.15 56.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.108 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.595 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 2.2 t -86.98 -26.17 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.078 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -70.45 -46.15 64.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.025 -1.047 . . . . 0.0 109.109 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -77.68 -34.22 53.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.393 -0.817 . . . . 0.0 109.625 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -69.22 -64.48 0.86 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.0 109.383 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.575 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 12.0 m-85 -51.25 -53.0 39.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 23' ' ' ASP . 1.4 t -63.7 -25.12 68.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.275 -0.891 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.467 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -54.92 -20.26 18.62 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -90.13 -29.44 18.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.256 -1.143 . . . . 0.0 109.658 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -83.35 69.94 10.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -0.931 . . . . 0.0 109.654 -179.838 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 47.02 96.7 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.4 OUTLIER 73.14 -149.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -1.177 . . . . 0.0 109.395 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.22 96.83 2.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.253 -0.905 . . . . 0.0 109.515 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.446 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 34.3 m-70 -145.63 -46.79 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 109.642 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.535 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 mttt -137.03 170.21 16.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 109.621 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.584 ' CD1' ' CD1' ' A' ' 35' ' ' LEU . 85.1 mt -115.5 131.33 56.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.191 -0.943 . . . . 0.0 109.558 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.466 ' O ' HD13 ' A' ' 32' ' ' LEU . 2.8 ptmt -76.78 164.03 26.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.206 -0.934 . . . . 0.0 108.768 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.453 ' HA ' HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -42.5 -27.18 0.14 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.92 . . . . 0.0 109.828 -179.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.464 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 3.5 m -77.45 -52.58 8.86 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 110.216 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.535 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 19.1 mm-40 -55.03 -39.1 68.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.307 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.578 ' CD2' ' CD1' ' A' ' 60' ' ' LEU . 0.9 OUTLIER -62.56 -70.17 0.22 Allowed 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.544 -0.723 . . . . 0.0 109.431 179.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -43.03 -26.61 0.15 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.165 -0.96 . . . . 0.0 109.586 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.492 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -71.4 -51.58 23.25 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.116 -0.99 . . . . 0.0 109.455 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.595 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 2.3 mt -60.15 -51.19 70.64 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.311 -0.868 . . . . 0.0 109.856 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.584 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 89.8 mt -62.08 -34.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 109.588 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 2.1 m-80 -92.46 -0.95 57.3 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.679 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 34' ' ' GLU . 0.8 OUTLIER -93.83 -43.44 8.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.529 ' CG ' ' HB2' ' B' ' 3' ' ' LEU . 54.5 mp0 -122.7 -10.06 8.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.31 -0.869 . . . . 0.0 109.4 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 36' ' ' ILE . 2.0 mp -108.6 -6.82 15.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.471 ' HB3' ' HA ' ' A' ' 37' ' ' ASN . 1.9 p . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.199 -0.938 . . . . 0.0 109.478 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.516 HD13 ' CG2' ' A' ' 53' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -43.51 -26.88 0.24 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 109.534 -179.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 47' ' ' ILE . 1.3 tp10 176.79 55.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.514 ' N ' HG23 ' A' ' 47' ' ' ILE . 13.1 mt-30 57.96 35.46 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.274 -0.891 . . . . 0.0 109.295 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -71.65 -70.15 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.239 -0.913 . . . . 0.0 109.756 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.546 ' CG1' ' HA ' ' A' ' 80' ' ' VAL . 3.3 t -83.42 -11.06 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.067 -1.02 . . . . 0.0 109.68 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.516 ' CG2' HD13 ' A' ' 47' ' ' ILE . 43.0 t -84.23 -37.43 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.828 -1.17 . . . . 0.0 108.32 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.2 t0 -90.2 -22.1 21.84 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 5.0 mttm -87.49 -48.42 7.96 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.488 -0.757 . . . . 0.0 109.207 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.539 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 1.2 p -64.19 -42.63 96.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 O-C-N 121.179 -0.951 . . . . 0.0 109.094 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.576 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 10.7 tpp -43.48 -45.49 6.45 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 5.4 tt0 -61.22 -44.17 97.7 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.236 -0.915 . . . . 0.0 108.827 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.418 ' O ' HG21 ' A' ' 59' ' ' THR . 52.0 m -62.55 -18.92 63.05 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.372 -0.83 . . . . 0.0 109.411 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.639 ' CD1' ' CD1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -91.5 28.82 1.61 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.196 -0.94 . . . . 0.0 108.898 179.571 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.434 ' OD1' ' HA2' ' A' ' 64' ' ' GLY . 6.6 t0 -85.99 98.48 10.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.489 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.9 -23.33 14.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -140.22 9.71 2.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.261 -0.899 . . . . 0.0 109.47 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' HA2' ' OD1' ' A' ' 61' ' ' ASP . . . 69.03 83.62 0.16 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 178.8 -33.55 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.22 -1.164 . . . . 0.0 108.576 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 14.52 13.32 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.535 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 3.3 pt-20 -87.28 114.93 24.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.3 -1.118 . . . . 0.0 109.469 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 18.8 t -69.74 157.79 36.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -120.69 172.15 8.08 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.531 ' CZ ' HG13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.73 -55.96 16.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.085 -1.009 . . . . 0.0 110.129 -179.81 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.488 ' HG3' ' N ' ' A' ' 72' ' ' GLU . 8.4 pt20 -62.14 -39.4 92.46 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 tt0 -78.68 -10.43 59.75 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.565 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 34.2 t80 -73.73 -51.44 16.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.54 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -64.69 -46.99 80.02 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.03 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.519 ' HB1' ' CB ' ' B' ' 75' ' ' ALA . . . -68.32 -20.75 64.77 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.319 -0.863 . . . . 0.0 109.012 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.639 ' CD1' ' CD1' ' A' ' 60' ' ' LEU . 4.6 t80 -66.68 -70.39 0.25 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.192 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.403 HG23 ' CD2' ' B' ' 3' ' ' LEU . 81.5 t -60.18 -30.38 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.236 -0.915 . . . . 0.0 108.934 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.548 ' HB1' ' CB ' ' B' ' 74' ' ' MET . . . -60.29 -41.99 94.53 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.415 -0.803 . . . . 0.0 109.196 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -63.33 -50.74 68.81 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.163 -0.961 . . . . 0.0 108.701 179.503 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.546 ' HA ' ' CG1' ' A' ' 52' ' ' VAL . 1.5 t -65.33 -9.53 7.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.696 0 O-C-N 121.085 -1.009 . . . . 0.0 109.583 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.511 ' CG2' ' SD ' ' B' ' 7' ' ' MET . 52.7 m -86.85 -57.76 2.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.223 -0.923 . . . . 0.0 109.382 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -81.91 -48.81 11.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.162 -0.961 . . . . 0.0 109.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.571 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -39.42 -42.65 1.12 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.704 -0.622 . . . . 0.0 109.871 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.16 -51.3 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.903 . . . . 0.0 109.519 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -74.2 -9.98 59.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 109.497 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 83' ' ' ALA . 3.2 mt-10 -75.07 -34.86 61.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' A' ' 86' ' ' GLU . 4.3 t80 . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 109.593 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.506 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.504 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 3.6 mm-40 -76.13 -35.85 59.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 109.3 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.529 ' HB2' ' CG ' ' A' ' 39' ' ' GLU . 7.5 mp -78.99 -28.1 43.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.285 -0.885 . . . . 0.0 109.442 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.506 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 4.9 tm-20 -68.84 -58.84 3.6 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.899 . . . . 0.0 109.192 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.524 ' O ' ' CG1' ' B' ' 8' ' ' VAL . 19.4 mttt -62.61 -37.2 85.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.223 -0.923 . . . . 0.0 109.161 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.522 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -66.9 -19.52 65.74 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.38 -0.825 . . . . 0.0 109.308 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.511 ' SD ' ' CG2' ' A' ' 81' ' ' THR . 10.4 tpt -81.84 -38.47 25.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.342 -0.849 . . . . 0.0 109.368 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.524 ' CG1' ' O ' ' B' ' 5' ' ' LYS . 2.6 p -68.27 -30.89 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.286 -0.884 . . . . 0.0 109.413 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.462 ' CB ' ' HB3' ' A' ' 2' ' ' GLU . . . -82.47 -52.46 6.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 109.395 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.594 ' CD1' ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -53.29 -40.87 65.07 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.538 ' CG2' ' N ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -68.86 -46.37 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.376 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.538 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 0.3 OUTLIER -51.89 -26.83 11.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 109.239 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.569 HG11 ' CD1' ' B' ' 17' ' ' TYR . 18.9 t -86.81 -30.87 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.26 -0.9 . . . . 0.0 109.366 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 2.7 t80 -59.48 -56.92 15.92 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.834 -1.166 . . . . 0.0 109.027 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.54 ' CE1' ' HB2' ' B' ' 24' ' ' LYS . 3.4 t60 -72.79 -48.41 38.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 109.636 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 44.9 tt0 -50.5 -68.39 0.18 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.841 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.583 ' CE2' ' CD1' ' B' ' 35' ' ' LEU . 25.4 m-85 -52.97 -32.77 47.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 110.072 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' B' ' 14' ' ' PHE . 86.3 p -87.36 31.57 0.73 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.044 -1.035 . . . . 0.0 109.942 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.02 -0.34 48.21 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.87 -58.27 2.63 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -1.17 . . . . 0.0 109.49 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.49 168.58 18.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.229 -0.92 . . . . 0.0 109.477 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.17 -105.88 3.17 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' B' ' 24' ' ' LYS . 0.2 OUTLIER -148.97 -68.67 0.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -1.143 . . . . 0.0 109.476 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' B' ' 15' ' ' HIS . 2.8 pttt 168.8 39.32 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.91 . . . . 0.0 109.503 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.574 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 3.9 p80 -169.74 27.53 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' B' ' 68' ' ' CYS . 4.5 ptpt -153.97 167.66 29.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.54 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 78.9 mt -138.34 119.2 14.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.226 -0.921 . . . . 0.0 109.874 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.0 OUTLIER -85.77 118.86 25.53 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.279 -0.888 . . . . 0.0 108.666 179.114 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.535 ' N ' ' CE ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER 20.1 -78.76 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' B' ' 28' ' ' LYS . 69.3 p -40.73 -58.42 1.65 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.979 -1.075 . . . . 0.0 110.794 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.54 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 31.1 mm-40 -45.93 -43.84 14.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.903 -1.123 . . . . 0.0 109.166 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.53 ' CD2' ' HB2' ' B' ' 27' ' ' LEU . 20.2 mt -53.26 -66.07 0.45 Allowed 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.56 -0.713 . . . . 0.0 109.12 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.52 ' HA ' ' CD1' ' B' ' 36' ' ' ILE . 0.1 OUTLIER -43.62 -36.27 2.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 109.646 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -54.97 -63.08 1.27 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 109.416 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.583 ' CD1' ' CE2' ' B' ' 17' ' ' TYR . 1.1 mp -50.71 -36.66 37.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.58 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.579 HG13 ' CZ ' ' B' ' 76' ' ' PHE . 4.1 mt -61.43 -39.27 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.706 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.461 ' OD1' ' HE2' ' B' ' 33' ' ' LYS . 0.7 OUTLIER -96.38 -70.08 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 109.679 -179.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -45.72 -24.34 0.35 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.289 -0.882 . . . . 0.0 109.963 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.525 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -113.91 -40.8 3.67 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.077 -1.015 . . . . 0.0 109.941 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 0.1 OUTLIER -109.52 67.98 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.132 -0.98 . . . . 0.0 109.601 -179.821 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.455 179.928 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.547 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 31.1 mm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.2 OUTLIER 84.4 -52.15 0.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.712 -0.618 . . . . 0.0 109.592 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.522 ' N ' ' CG ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -174.21 34.96 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.482 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 5.8 mt-30 73.73 38.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -65.47 -70.26 0.25 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.178 -0.951 . . . . 0.0 109.394 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.583 ' CG1' ' CG1' ' B' ' 80' ' ' VAL . 2.4 t -87.56 -15.41 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.142 -0.974 . . . . 0.0 109.152 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.52 ' CG1' ' HG3' ' B' ' 33' ' ' LYS . 39.5 t -75.17 -29.83 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.204 -0.935 . . . . 0.0 108.746 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 6.1 t0 -90.13 -36.92 14.56 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.425 -0.797 . . . . 0.0 109.314 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.461 ' HA ' ' OE2' ' B' ' 58' ' ' GLU . 23.7 mtpp -70.63 -36.17 73.32 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.316 -0.865 . . . . 0.0 109.534 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.533 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 5.3 m -55.44 -56.13 13.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' B' ' 61' ' ' ASP . 0.2 OUTLIER -41.11 -28.32 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.93 -1.106 . . . . 0.0 109.625 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' B' ' 56' ' ' VAL . 45.0 mt-10 -70.06 -55.6 9.09 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' B' ' 60' ' ' LEU . 2.8 m -82.81 -63.06 1.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.584 HD23 ' CD1' ' B' ' 76' ' ' PHE . 1.7 mp -37.2 -36.5 0.14 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.761 -0.587 . . . . 0.0 109.898 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.524 ' CB ' ' O ' ' B' ' 57' ' ' MET . 11.1 t0 -90.11 70.03 7.29 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.398 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -100.09 8.88 43.61 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.9 -10.74 17.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.468 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 63.85 78.39 0.19 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 58.8 t0 178.99 -33.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.25 -1.147 . . . . 0.0 108.602 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 -9.37 31.52 Favored Glycine 0 N--CA 1.486 1.973 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' B' ' 67' ' ' GLU . 12.2 pt-20 -95.56 123.74 39.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -1.148 . . . . 0.0 109.474 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.476 ' SG ' ' CG ' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -69.63 133.42 47.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.273 -0.892 . . . . 0.0 109.338 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.477 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 23.0 t70 -98.05 170.76 8.7 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -55.74 -47.7 76.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.042 . . . . 0.0 110.061 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.458 ' HG2' ' SD ' ' A' ' 79' ' ' MET . 65.6 mt-30 -50.56 -49.31 56.41 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.546 -0.721 . . . . 0.0 109.319 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.53 ' OE1' ' CG ' ' B' ' 60' ' ' LEU . 0.0 OUTLIER -72.17 -20.83 61.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.541 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.594 ' CE2' ' CD1' ' B' ' 10' ' ' LEU . 71.8 t80 -59.86 -57.78 11.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.548 ' CB ' ' HB1' ' A' ' 78' ' ' ALA . 3.4 mtt -66.61 -44.14 82.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.332 -0.855 . . . . 0.0 109.605 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.519 ' CB ' ' HB1' ' A' ' 75' ' ' ALA . . . -68.61 -12.21 61.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.081 -1.012 . . . . 0.0 109.21 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.584 ' CD1' HD23 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -81.52 -70.52 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.337 -0.852 . . . . 0.0 109.282 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.528 ' CG2' HD21 ' B' ' 35' ' ' LEU . 98.5 t -60.59 -30.25 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.88 . . . . 0.0 108.858 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.54 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -66.16 -45.57 80.49 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.459 -0.776 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.535 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 4.3 mmm -63.17 -70.34 0.22 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.059 -1.026 . . . . 0.0 108.914 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.583 ' CG1' ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -41.81 -26.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 120.891 -1.131 . . . . 0.0 109.553 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.488 ' N ' ' O ' ' B' ' 79' ' ' MET . 15.2 m -71.05 -70.23 0.32 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.053 -1.03 . . . . 0.0 108.885 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.0 OUTLIER -79.23 -50.77 10.41 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.113 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.581 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.4 -37.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.262 0.553 . . . . 0.0 109.848 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 8.6 t -84.88 -39.53 18.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 109.557 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -65.38 -9.98 29.49 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.605 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.492 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 0.5 OUTLIER -87.78 -21.55 25.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.241 -0.912 . . . . 0.0 109.525 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . 0.474 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.9 t80 . . . . . 0 N--CA 1.489 1.519 0 O-C-N 121.286 -0.884 . . . . 0.0 109.519 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.46 ' N ' ' HB2' ' A' ' 4' ' ' GLU . 1.1 t . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.65 -49.2 28.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.0 109.534 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.516 ' CD2' ' HG ' ' B' ' 10' ' ' LEU . 2.3 mp -76.49 -23.38 53.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.46 ' HB2' ' N ' ' A' ' 1' ' ' SER . 2.0 mt-10 -62.42 -63.91 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.346 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -38.59 90.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.311 -0.868 . . . . 0.0 109.297 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' HB2' ' CB ' ' B' ' 6' ' ' ALA . . . -70.63 -15.55 62.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.298 -0.876 . . . . 0.0 109.428 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.06 -46.49 16.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.316 -0.865 . . . . 0.0 109.385 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.11 -41.93 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.457 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.453 ' CB ' ' OE1' ' B' ' 2' ' ' GLU . . . -67.7 -54.18 21.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.922 . . . . 0.0 109.42 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.569 HD22 ' CZ ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -47.68 -46.37 29.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.2 -0.937 . . . . 0.0 109.397 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.415 HG23 HD11 ' A' ' 11' ' ' ILE . 45.5 mt -59.3 -38.95 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.396 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 91.3 m-20 -64.63 -24.46 67.59 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.262 -0.899 . . . . 0.0 109.532 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.557 HG12 ' CD1' ' A' ' 17' ' ' TYR . 2.7 t -81.01 -29.87 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 10.9 t80 -69.63 -47.77 62.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.941 -1.099 . . . . 0.0 109.507 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -78.99 -33.43 45.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.558 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 39.1 tt0 -68.82 -64.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.907 . . . . 0.0 109.468 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.626 ' CZ ' ' CD1' ' A' ' 35' ' ' LEU . 26.0 m-85 -55.4 -48.23 74.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.5 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 33.7 t -69.64 -19.03 63.62 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.289 -0.882 . . . . 0.0 109.47 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.38 16.09 59.77 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 22.4 mmm180 -81.46 -46.65 14.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.492 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.427 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 1.0 OUTLIER -74.2 169.72 17.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.277 -0.889 . . . . 0.0 109.498 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.54 -52.87 7.28 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.0 -162.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -1.169 . . . . 0.0 109.421 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 179.5 80.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.297 -0.877 . . . . 0.0 109.449 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -152.82 -39.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.527 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -144.13 168.11 20.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.587 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.546 ' HB2' ' CD2' ' A' ' 32' ' ' LEU . 56.6 mt -86.17 152.08 23.12 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.339 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -119.16 69.45 0.82 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.777 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HD3' ' N ' ' A' ' 30' ' ' SER . 1.6 tmtt? 64.48 -81.6 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.518 -0.739 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.508 ' N ' ' HD3' ' A' ' 29' ' ' LYS . 4.3 m -48.28 -32.4 7.25 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.87 -1.144 . . . . 0.0 110.187 -179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.534 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 7.4 mm-40 -64.5 -43.01 95.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.962 -1.086 . . . . 0.0 108.568 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.546 ' CD2' ' HB2' ' A' ' 27' ' ' LEU . 3.2 mm? -55.93 -61.45 2.37 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.467 ' CG ' HG12 ' A' ' 53' ' ' VAL . 2.3 ttmt -52.15 -36.58 51.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.44 -0.788 . . . . 0.0 109.829 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -38.44 79.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 0.0 109.534 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.626 ' CD1' ' CZ ' ' A' ' 17' ' ' TYR . 13.3 tp -75.14 -38.68 60.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.338 -0.851 . . . . 0.0 109.995 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.583 HG12 ' CE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -75.75 -14.16 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 109.744 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.467 ' HA ' ' OG ' ' A' ' 41' ' ' SER . 1.8 m-80 -93.82 -57.02 2.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.973 -1.08 . . . . 0.0 109.756 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -73.92 -10.94 60.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.236 -0.915 . . . . 0.0 109.723 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.519 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 2.5 mm-40 -121.01 -33.31 3.76 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.065 -1.022 . . . . 0.0 109.968 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.525 ' CD2' ' HB ' ' A' ' 80' ' ' VAL . 7.4 mp -117.9 66.0 0.75 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.047 -1.033 . . . . 0.0 109.606 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.467 ' OG ' ' HA ' ' A' ' 37' ' ' ASN . 7.7 m . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.296 -0.878 . . . . 0.0 109.374 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.586 ' CD1' ' CG2' ' A' ' 53' ' ' VAL . 24.3 mm . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.336 0.588 . . . . 0.0 109.434 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.7 pttt 39.7 25.22 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.666 -0.646 . . . . 0.0 111.185 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 mt-10 161.13 34.07 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.998 -1.063 . . . . 0.0 110.244 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.532 ' N ' HG21 ' A' ' 47' ' ' ILE . 32.0 mt-30 40.33 37.11 0.39 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.278 -0.889 . . . . 0.0 109.748 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -68.45 -70.51 0.26 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.157 -0.964 . . . . 0.0 109.627 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.531 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.3 t -80.86 -9.78 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.058 -1.026 . . . . 0.0 109.158 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.586 ' CG2' ' CD1' ' A' ' 47' ' ' ILE . 55.9 t -80.83 -45.91 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.19 -0.944 . . . . 0.0 108.939 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.14 -28.3 60.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.457 -0.777 . . . . 0.0 108.959 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -56.33 4.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.39 -0.819 . . . . 0.0 109.257 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.531 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 17.1 m -57.08 -48.15 82.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.054 -1.029 . . . . 0.0 109.542 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.503 ' CE ' ' HA ' ' A' ' 29' ' ' LYS . 19.1 tpp -42.89 -45.14 4.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.205 -0.934 . . . . 0.0 109.68 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.77 -49.25 73.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.18 -0.95 . . . . 0.0 109.489 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.468 HG21 ' HG ' ' A' ' 60' ' ' LEU . 4.5 t -77.53 -8.97 58.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.288 -0.883 . . . . 0.0 109.913 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.538 ' CD2' ' HB2' ' A' ' 76' ' ' PHE . 13.2 mt -97.27 11.58 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 109.397 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -77.97 113.88 16.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.245 -0.909 . . . . 0.0 109.511 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.507 ' ND2' ' HB2' ' A' ' 69' ' ' ASP . 13.6 t-20 -60.28 -50.37 73.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 109.477 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -150.35 16.5 0.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.176 -0.953 . . . . 0.0 109.589 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.08 75.18 1.29 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -176.98 30.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -1.163 . . . . 0.0 108.406 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.463 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 49.31 22.43 3.52 Favored Glycine 0 N--CA 1.482 1.758 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.3 mt-10 -106.76 96.57 6.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -1.141 . . . . 0.0 109.436 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.465 ' HA ' ' OE2' ' A' ' 72' ' ' GLU . 56.3 m -69.97 162.25 28.46 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.218 -0.926 . . . . 0.0 109.835 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.507 ' HB2' ' ND2' ' A' ' 62' ' ' ASN . 20.9 t70 -128.18 170.95 12.4 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -52.55 -51.22 60.74 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.093 -1.004 . . . . 0.0 110.203 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.461 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 0.5 OUTLIER -54.82 -30.6 57.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.28 -0.887 . . . . 0.0 109.103 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' CD2' ' A' ' 60' ' ' LEU . 3.8 mt-10 -82.52 -24.87 33.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.569 ' CZ ' HD22 ' A' ' 10' ' ' LEU . 1.2 t80 -63.93 -57.55 9.44 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.121 -0.987 . . . . 0.0 108.642 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.536 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.1 OUTLIER -64.15 -48.88 74.33 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.343 -0.848 . . . . 0.0 108.763 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' A' ' 71' ' ' GLN . . . -55.52 -25.16 35.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.624 ' CG ' ' N ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -67.29 -69.41 0.31 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.438 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.624 ' N ' ' CG ' ' A' ' 76' ' ' PHE . 40.0 t -53.45 -21.11 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.408 -0.807 . . . . 0.0 109.057 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.515 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -66.05 -50.29 64.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.332 -0.855 . . . . 0.0 109.484 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 44.8 mtp -73.6 -63.56 1.18 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.62 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.525 HG11 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.32 -22.83 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.842 0 O-C-N 120.565 -1.335 . . . . 0.0 109.41 -179.059 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.53 ' CG2' HD12 ' B' ' 11' ' ' ILE . 3.3 m -80.32 -68.83 0.64 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.03 -1.044 . . . . 0.0 109.123 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.8 t -74.32 -49.46 22.87 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.98 -1.075 . . . . 0.0 109.088 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.561 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -37.19 -31.08 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.421 0.629 . . . . 0.0 109.607 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.488 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.9 t -81.03 -58.36 3.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.0 109.288 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -45.05 -60.99 1.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.279 -0.888 . . . . 0.0 109.482 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -53.42 -47.53 69.53 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.39 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 58.8 t80 . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.516 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.453 ' OE1' ' CB ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -70.96 -70.08 0.33 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.92 . . . . 0.0 109.485 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.556 ' N ' ' CD2' ' B' ' 3' ' ' LEU . 3.3 mm? -75.12 -17.59 60.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.26 -0.9 . . . . 0.0 109.393 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' B' ' 7' ' ' MET . 22.5 tt0 -73.36 -61.72 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.418 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.459 ' O ' HG11 ' B' ' 8' ' ' VAL . 7.4 ttmt -61.0 -51.19 70.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.515 ' CB ' ' HB2' ' A' ' 6' ' ' ALA . . . -58.86 -15.76 14.09 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.505 ' SD ' ' CD1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -82.29 -53.86 5.7 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.496 HG11 ' N ' ' B' ' 9' ' ' ALA . 9.4 p -55.7 -28.55 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.241 -0.912 . . . . 0.0 109.545 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.496 ' N ' HG11 ' B' ' 8' ' ' VAL . . . -78.47 -62.91 1.53 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.516 ' HG ' ' CD2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -50.71 -21.71 1.74 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.931 . . . . 0.0 109.557 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' A' ' 81' ' ' THR . 73.8 mt -77.02 -62.43 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -48.17 -23.39 0.84 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.231 -0.918 . . . . 0.0 109.535 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.501 HG11 ' N ' ' B' ' 14' ' ' PHE . 0.3 OUTLIER -81.61 -40.38 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.513 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 28.1 t80 -57.05 -50.5 72.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.12 -0.987 . . . . 0.0 109.254 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.451 ' HA ' ' HB2' ' B' ' 18' ' ' SER . 14.7 m170 -67.85 -35.92 79.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.412 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -51.56 -57.45 9.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.484 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.635 ' CE2' ' CD1' ' B' ' 35' ' ' LEU . 78.8 m-85 -64.82 -28.05 69.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.225 -0.922 . . . . 0.0 109.482 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 0.6 OUTLIER -65.72 -20.94 66.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.925 . . . . 0.0 109.521 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.51 16.99 59.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 29.5 mmt180 -90.08 -57.48 2.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.256 -1.143 . . . . 0.0 109.432 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 165.73 23.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.297 -0.877 . . . . 0.0 109.409 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.11 -122.59 5.86 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.445 ' HB2' ' HE2' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -94.03 -156.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.292 -1.122 . . . . 0.0 109.517 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' B' ' 25' ' ' HIS . 13.0 mtmm -132.46 28.09 4.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 16.0 m170 -162.46 26.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.268 -0.895 . . . . 0.0 109.47 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.06 143.59 2.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.283 -0.885 . . . . 0.0 109.445 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.54 HD11 ' CB ' ' B' ' 31' ' ' GLU . 0.9 OUTLIER -93.24 167.27 11.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.957 . . . . 0.0 109.555 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.1 OUTLIER -135.7 80.58 1.84 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.388 -0.82 . . . . 0.0 109.369 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 64.0 -84.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.74 . . . . 0.0 110.32 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 29' ' ' LYS . 2.5 m -41.71 -57.51 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.136 -0.978 . . . . 0.0 110.482 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.54 ' CB ' HD11 ' B' ' 27' ' ' LEU . 64.7 mm-40 -61.15 -33.07 72.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.897 -1.127 . . . . 0.0 109.597 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.586 ' CD1' ' CE ' ' B' ' 57' ' ' MET . 52.4 mt -56.0 -68.87 0.17 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.386 -0.821 . . . . 0.0 108.847 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.519 ' CD ' HG13 ' B' ' 53' ' ' VAL . 2.8 mttt -44.15 -33.88 1.66 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.32 -0.863 . . . . 0.0 109.073 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -58.73 -66.57 0.48 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.478 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.635 ' CD1' ' CE2' ' B' ' 17' ' ' TYR . 4.2 mm? -42.7 -40.65 2.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.88 . . . . 0.0 109.737 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.581 HD12 ' CZ ' ' B' ' 76' ' ' PHE . 2.8 mm -59.92 -50.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.227 -0.92 . . . . 0.0 109.687 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.14 6.29 14.25 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.235 -0.915 . . . . 0.0 109.612 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -127.44 7.03 6.35 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.184 -0.947 . . . . 0.0 109.714 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.515 ' HB2' ' CB ' ' A' ' 3' ' ' LEU . 5.8 pt-20 -142.87 -33.74 0.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.177 -0.952 . . . . 0.0 110.155 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.534 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.8 mm? -52.55 -69.07 0.12 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.016 -1.052 . . . . 0.0 109.403 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.9 p . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.397 -0.815 . . . . 0.0 109.389 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.555 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 14.5 mm . . . . . 0 N--CA 1.497 1.894 0 CA-C-O 120.694 0.283 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 84.58 -36.28 0.06 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.392 -0.818 . . . . 0.0 109.82 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.523 ' N ' ' HG2' ' B' ' 48' ' ' LYS . 5.0 tt0 178.46 33.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.076 -1.015 . . . . 0.0 109.48 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.442 ' HA ' HG22 ' B' ' 47' ' ' ILE . 0.9 OUTLIER 50.14 51.32 16.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.13 -57.28 2.91 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.635 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.501 ' O ' ' HB ' ' B' ' 56' ' ' VAL . 40.1 t -86.97 -13.58 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.655 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.519 HG13 ' CD ' ' B' ' 33' ' ' LYS . 37.7 t -77.47 -15.62 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 120.902 -1.124 . . . . 0.0 109.339 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -48.84 6.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.327 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -72.31 -42.04 65.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.874 . . . . 0.0 109.383 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.631 ' CG2' ' CE1' ' B' ' 76' ' ' PHE . 5.4 p -56.4 -46.48 81.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.203 -0.936 . . . . 0.0 109.386 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' B' ' 32' ' ' LEU . 8.1 tpp -42.79 -47.1 5.43 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.416 -0.802 . . . . 0.0 109.169 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.447 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.9 OUTLIER -57.14 -45.11 83.81 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.749 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.517 HG22 ' CE ' ' B' ' 79' ' ' MET . 3.9 t -75.14 -12.24 60.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.0 110.077 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.579 HD12 ' CE2' ' B' ' 76' ' ' PHE . 34.1 mt -91.12 -9.03 47.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.34 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 17.1 p-10 -62.6 113.39 2.96 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.276 -0.89 . . . . 0.0 109.576 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.516 ' CA ' ' OE2' ' B' ' 72' ' ' GLU . 9.1 p-10 -81.17 -45.89 15.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.266 -0.896 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . 0.43 ' N ' ' CG ' ' B' ' 62' ' ' ASN . 0.6 OUTLIER -131.77 1.0 3.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 75.51 1.2 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -175.3 29.83 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -1.156 . . . . 0.0 108.385 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.3 26.26 6.6 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.452 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 87.0 mt-10 -105.76 111.95 24.83 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -1.136 . . . . 0.0 109.437 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 16.2 t -69.64 159.02 34.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.493 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.3 OUTLIER -130.03 172.54 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.424 -0.797 . . . . 0.0 109.249 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.446 ' HB3' HG23 ' A' ' 82' ' ' THR . 0.2 OUTLIER -58.33 -53.56 56.88 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.377 -0.827 . . . . 0.0 110.466 -179.667 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.47 ' HA ' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.87 -40.55 89.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.28 -0.887 . . . . 0.0 108.611 -179.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.516 ' OE2' ' CA ' ' B' ' 62' ' ' ASN . 0.3 OUTLIER -76.48 -12.07 59.98 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.442 -0.786 . . . . 0.0 109.083 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.556 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 8.5 t80 -73.26 -57.99 3.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.523 ' CG ' ' HG2' ' A' ' 74' ' ' MET . 0.0 OUTLIER -59.51 -45.72 90.91 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.102 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.452 ' O ' ' SD ' ' B' ' 79' ' ' MET . . . -60.02 -33.18 71.65 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.353 -0.842 . . . . 0.0 108.784 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.631 ' CE1' ' CG2' ' B' ' 56' ' ' VAL . 1.0 OUTLIER -57.26 -70.03 0.14 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.014 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.515 ' CG1' ' HG3' ' B' ' 39' ' ' GLU . 6.7 t -50.22 -32.34 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.468 -0.77 . . . . 0.0 109.31 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.536 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -58.98 -45.55 90.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 109.867 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 2.7 mpp? -76.46 -68.4 0.6 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.197 -0.94 . . . . 0.0 109.825 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.585 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -45.29 -24.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.452 -1.405 . . . . 0.0 109.441 -179.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.504 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 8.5 m -77.7 -68.1 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.051 -1.031 . . . . 0.0 108.916 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -79.08 -49.65 12.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 108.798 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.574 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.69 -37.43 0.22 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.742 -0.599 . . . . 0.0 109.789 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 43.3 t -72.96 -48.31 37.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.3 -0.875 . . . . 0.0 109.47 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.66 -10.06 32.86 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.243 -0.911 . . . . 0.0 109.473 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -38.52 69.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 0.0 109.411 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.305 -0.872 . . . . 0.0 109.442 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 29.6 t . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.371 0.605 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.32 -70.67 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 109.913 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.525 ' CD2' ' OE2' ' B' ' 39' ' ' GLU . 6.0 mt -78.51 -33.13 48.3 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.118 -0.989 . . . . 0.0 110.02 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.465 ' O ' ' HB3' ' A' ' 7' ' ' MET . 11.5 tt0 -57.77 -59.97 4.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.086 -1.008 . . . . 0.0 109.246 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.17 -53.21 59.86 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.347 -0.845 . . . . 0.0 109.469 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.52 ' HB3' ' CB ' ' B' ' 6' ' ' ALA . . . -61.24 -12.84 14.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.295 -0.878 . . . . 0.0 109.671 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.526 ' O ' ' CD1' ' A' ' 11' ' ' ILE . 4.9 ttp -80.29 -60.43 2.33 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.172 -0.955 . . . . 0.0 109.435 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 4.2 t -55.01 -27.89 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.482 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -77.82 -64.31 1.18 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.63 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.518 ' CD1' ' HB2' ' B' ' 6' ' ' ALA . 0.2 OUTLIER -43.3 -53.4 5.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 0.0 109.754 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.526 ' CD1' ' O ' ' A' ' 7' ' ' MET . 2.1 mp -59.24 -45.88 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.275 -0.891 . . . . 0.0 109.583 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 0.5 OUTLIER -55.74 -23.48 29.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.195 -0.941 . . . . 0.0 109.413 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.564 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 1.2 t -89.13 -27.09 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.259 -0.901 . . . . 0.0 109.231 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.576 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 10.3 t80 -64.67 -42.4 95.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.012 -1.055 . . . . 0.0 109.057 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.568 ' CE1' ' CE1' ' A' ' 25' ' ' HIS . 3.8 m-70 -82.4 -44.37 16.18 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.325 -0.859 . . . . 0.0 109.518 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -52.8 -59.44 4.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.495 ' CD1' HG12 ' A' ' 13' ' ' VAL . 34.6 m-85 -61.85 -45.76 92.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.891 . . . . 0.0 109.616 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.517 ' OG ' ' CD1' ' A' ' 27' ' ' LEU . 48.2 m -72.26 -3.08 21.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.772 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 15' ' ' HIS . . . -75.1 -9.16 83.95 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.44 ' HD3' ' OE2' ' A' ' 31' ' ' GLU . 16.9 mtt85 -87.93 -34.68 18.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.305 -1.115 . . . . 0.0 109.462 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 8.9 tt0 -69.94 154.4 42.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.299 -0.876 . . . . 0.0 109.381 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -43.49 -26.94 0.73 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.465 ' OD2' ' HD3' ' A' ' 26' ' ' LYS . 37.1 t70 -112.34 135.62 52.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 18' ' ' SER . 6.4 ptmt -91.99 70.91 5.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.287 -0.883 . . . . 0.0 109.571 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.576 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -170.2 -34.79 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -118.75 151.05 38.74 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.975 . . . . 0.0 109.785 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.545 ' CD2' ' CD1' ' A' ' 35' ' ' LEU . 7.2 mp -89.77 165.92 13.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.232 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 10.4 pttp -122.47 69.94 0.98 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.203 -0.935 . . . . 0.0 109.634 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.495 ' HG2' ' N ' ' A' ' 30' ' ' SER . 0.3 OUTLIER 62.18 -84.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.453 -0.779 . . . . 0.0 110.339 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.495 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 7.9 t -46.1 -42.22 13.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.169 -0.957 . . . . 0.0 110.445 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 67.5 mm-40 -56.77 -42.46 79.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.906 -1.121 . . . . 0.0 109.146 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.533 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 33.1 mt -60.15 -65.53 0.67 Allowed 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.511 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 2.4 ttpp -40.8 -29.61 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.369 -0.832 . . . . 0.0 109.52 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -66.81 -58.1 5.72 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.322 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.564 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.8 -29.08 17.66 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.36 -0.837 . . . . 0.0 109.569 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.576 HD12 ' CE1' ' A' ' 76' ' ' PHE . 3.0 mp -74.46 -40.02 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.148 -0.97 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.511 ' ND2' ' HG3' ' A' ' 33' ' ' LYS . 73.2 m-80 -90.19 6.1 44.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 109.689 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.71 -37.58 5.63 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 109.414 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.485 ' HG2' ' N ' ' A' ' 40' ' ' LEU . 1.9 pt-20 -111.76 -25.82 9.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.315 -0.866 . . . . 0.0 109.327 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.524 ' CD1' ' HB ' ' A' ' 80' ' ' VAL . 89.2 mt -108.28 69.44 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.552 ' O ' ' CG ' ' A' ' 48' ' ' LYS . 5.5 mm . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 85.53 -32.15 0.05 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.814 -0.554 . . . . 0.0 109.767 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 3.2 mt-10 162.52 64.7 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.193 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.2 OUTLIER 33.45 48.35 0.18 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.247 0.546 . . . . 0.0 110.045 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.407 ' C ' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -90.05 -62.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.347 -0.846 . . . . 0.0 109.772 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.537 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 1.6 t -88.35 -14.33 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.072 -1.017 . . . . 0.0 109.92 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.518 ' CG2' HD13 ' A' ' 47' ' ' ILE . 27.4 t -84.01 -28.43 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.832 -1.167 . . . . 0.0 108.68 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.69 -33.23 20.11 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.27 -0.894 . . . . 0.0 108.773 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -51.43 7.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.82 . . . . 0.0 108.974 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 0.9 OUTLIER -60.62 -41.87 89.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 O-C-N 121.159 -0.963 . . . . 0.0 108.896 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.533 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 7.1 tpt -42.01 -50.02 4.64 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.595 -0.69 . . . . 0.0 109.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -43.85 88.28 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.233 -0.917 . . . . 0.0 108.942 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.475 HG23 ' CE ' ' A' ' 79' ' ' MET . 15.8 m -62.23 -23.8 66.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.359 -0.838 . . . . 0.0 109.652 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -85.66 -27.43 25.38 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.13 -0.981 . . . . 0.0 109.275 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.472 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 82.2 m-20 -63.41 114.08 3.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.224 -0.922 . . . . 0.0 109.51 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -47.95 -43.08 28.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 109.425 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.99 25.82 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.441 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.16 88.84 2.04 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.11 -34.43 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.2 -1.177 . . . . 0.0 108.622 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 27' ' ' LEU . . . 110.1 -19.02 27.96 Favored Glycine 0 N--CA 1.485 1.947 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.402 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 26.8 mt-10 -73.11 97.4 2.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 109.541 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 12.9 t -69.79 154.28 42.18 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.198 -0.939 . . . . 0.0 109.619 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.457 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -113.32 171.33 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.806 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.464 ' HB3' HG22 ' B' ' 82' ' ' THR . 0.1 OUTLIER -61.39 -50.13 74.11 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.229 -0.919 . . . . 0.0 110.091 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.521 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 4.4 mp0 -54.83 -40.05 69.2 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.316 -0.865 . . . . 0.0 109.145 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.476 ' HB3' ' HA ' ' A' ' 60' ' ' LEU . 2.4 mt-10 -79.69 -17.82 52.74 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.306 -0.871 . . . . 0.0 109.663 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.571 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 22.1 t80 -69.56 -54.72 12.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.07 -1.019 . . . . 0.0 108.84 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.528 ' HG2' ' CG ' ' B' ' 74' ' ' MET . 1.6 ttm -64.42 -44.4 91.35 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.278 -0.889 . . . . 0.0 108.787 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' ' CE ' ' A' ' 79' ' ' MET . . . -64.04 -25.11 67.97 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.303 -0.873 . . . . 0.0 108.817 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.576 ' CE1' HD12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -64.09 -65.72 0.64 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.569 HG21 ' CE2' ' A' ' 76' ' ' PHE . 39.9 t -61.31 -22.14 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.885 . . . . 0.0 108.95 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.544 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -66.42 -40.97 89.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.365 -0.834 . . . . 0.0 109.341 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.567 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 49.3 mtm -78.02 -66.26 0.87 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.281 -0.887 . . . . 0.0 109.42 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.537 ' CG1' ' HB ' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.48 -22.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 O-C-N 120.474 -1.391 . . . . 0.0 109.462 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.495 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 6.2 m -80.67 -68.0 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.002 -1.061 . . . . 0.0 109.096 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.557 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.4 t -75.94 -49.33 18.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.0 109.089 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.567 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -36.52 -40.89 0.27 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.707 -0.621 . . . . 0.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.4 t -77.4 -42.57 35.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -0.906 . . . . 0.0 109.523 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 82' ' ' THR . 21.8 t-160 -64.44 -11.0 28.85 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.219 -0.926 . . . . 0.0 109.522 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -39.04 21.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.286 -0.884 . . . . 0.0 109.504 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.0 t80 . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.256 -0.903 . . . . 0.0 109.502 -179.985 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.507 ' CB ' HG22 ' A' ' 13' ' ' VAL . 2.1 mp0 -72.74 -69.26 0.42 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.423 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.533 ' N ' ' CD1' ' B' ' 3' ' ' LEU . 6.2 mp -65.39 -11.16 39.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.905 . . . . 0.0 109.468 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.501 ' O ' ' CG2' ' B' ' 8' ' ' VAL . 30.9 tt0 -73.83 -62.58 1.45 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.219 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -65.39 -36.55 84.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.268 -0.895 . . . . 0.0 109.135 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' A' ' 6' ' ' ALA . . . -64.27 -66.46 0.54 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.308 -0.87 . . . . 0.0 109.433 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.465 ' O ' HG12 ' B' ' 11' ' ' ILE . 0.4 OUTLIER -45.3 -30.81 1.36 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.309 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.501 ' CG2' ' O ' ' B' ' 4' ' ' GLU . 79.6 t -60.64 -55.61 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.122 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -44.92 87.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.177 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.439 HD13 HD22 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -58.76 -26.44 64.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.312 -0.868 . . . . 0.0 109.34 179.824 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.514 HD12 ' CZ ' ' B' ' 70' ' ' PHE . 9.0 mm -70.08 -48.29 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.267 -0.895 . . . . 0.0 109.108 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.469 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.8 OUTLIER -65.43 -19.03 65.77 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.49 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.456 HG12 HD13 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -88.22 -30.85 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.227 -0.92 . . . . 0.0 109.338 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 18.8 t80 -67.91 -46.07 72.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.02 -1.05 . . . . 0.0 109.214 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.437 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 53.6 m170 -79.53 -34.24 41.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.242 -0.911 . . . . 0.0 109.64 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -62.7 -61.75 2.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 109.455 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.626 ' CG ' ' CD2' ' B' ' 35' ' ' LEU . 35.9 m-85 -58.19 -44.58 88.14 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.233 -0.917 . . . . 0.0 109.614 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 83.4 p -67.0 -18.88 65.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.565 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.85 13.73 66.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.07 -38.24 13.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -1.158 . . . . 0.0 109.435 179.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -166.05 140.36 4.46 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 109.468 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 23' ' ' ASP . . . 84.28 -149.39 24.95 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.452 ' O ' ' O ' ' B' ' 18' ' ' SER . 4.0 p30 -54.75 -169.55 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.8 ptpt -134.12 11.85 3.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -138.27 7.15 2.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 109.595 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.514 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -143.07 170.14 16.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.557 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 4.2 mp -121.96 139.26 53.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.165 -0.959 . . . . 0.0 110.3 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.521 ' O ' ' N ' ' B' ' 30' ' ' SER . 14.7 tttm -86.18 156.95 20.11 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.504 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 11.8 mttt -37.46 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.062 -1.023 . . . . 0.0 109.987 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.521 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.5 OUTLIER -79.0 -45.95 19.19 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.557 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.2 OUTLIER -58.47 -40.26 82.22 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 120.808 -1.182 . . . . 0.0 108.776 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.523 HD23 ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -59.12 -63.4 1.32 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.523 ' CG ' HG13 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -39.97 -44.21 1.67 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.514 -0.741 . . . . 0.0 109.871 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.46 -61.04 2.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.626 ' CD2' ' CG ' ' B' ' 17' ' ' TYR . 2.4 mm? -49.29 -58.56 4.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -0.864 . . . . 0.0 109.804 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.596 HG12 ' CE1' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -43.23 -35.34 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.31 -0.869 . . . . 0.0 109.739 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -73.67 -54.8 7.28 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 110.142 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' B' ' 38' ' ' ASN . 1.5 m120 -96.29 27.59 3.66 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.171 -0.956 . . . . 0.0 109.579 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CD2' ' A' ' 3' ' ' LEU . 21.5 tt0 -127.79 -37.79 1.92 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.236 -0.915 . . . . 0.0 109.321 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.3 mm? -73.02 -56.26 5.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.313 -0.867 . . . . 0.0 109.285 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 5.4 t . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.499 -0.75 . . . . 0.0 108.978 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.535 ' CG2' ' O ' ' B' ' 47' ' ' ILE . 23.3 mm . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.26 0.552 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.481 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 42.98 26.2 0.07 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.08 -1.012 . . . . 0.0 109.577 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.481 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.4 tt0 75.02 87.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.115 -0.991 . . . . 0.0 109.83 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.49 ' N ' HG23 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 42.39 50.66 4.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.322 -0.861 . . . . 0.0 109.839 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.457 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 5.5 tp10 -91.2 -70.57 0.68 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.174 -0.954 . . . . 0.0 109.705 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.533 ' CG1' ' CG1' ' B' ' 80' ' ' VAL . 2.0 t -91.51 -15.04 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.182 -0.949 . . . . 0.0 109.38 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.523 HG13 ' CG ' ' B' ' 33' ' ' LYS . 62.3 t -84.28 -30.01 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 120.966 -1.084 . . . . 0.0 108.594 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 10.1 t0 -90.18 -29.08 18.47 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.308 -0.87 . . . . 0.0 108.873 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 10.5 mtmt -85.27 -47.93 9.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.392 -0.817 . . . . 0.0 109.23 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 0.6 OUTLIER -65.66 -40.67 88.61 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.124 -0.985 . . . . 0.0 109.006 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.52 ' SD ' ' CD1' ' B' ' 32' ' ' LEU . 8.0 tpt -39.9 -52.53 2.39 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.763 -0.586 . . . . 0.0 109.723 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.73 -42.27 96.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.196 -0.94 . . . . 0.0 108.863 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.418 ' O ' HG21 ' B' ' 59' ' ' THR . 96.6 m -62.22 -20.51 64.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.363 -0.836 . . . . 0.0 109.799 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.537 ' CD2' ' HB2' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -85.33 -73.62 0.43 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.041 -1.037 . . . . 0.0 109.189 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.453 ' HA ' ' OE1' ' B' ' 72' ' ' GLU . 9.8 t70 -84.64 93.12 8.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.28 -0.888 . . . . 0.0 109.547 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.29 10.74 40.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.907 . . . . 0.0 109.369 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -92.43 -41.84 10.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 109.558 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 90.05 2.1 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -172.87 -37.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.293 -1.122 . . . . 0.0 108.463 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 32.88 3.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.514 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 5.2 mt-10 -144.9 113.11 6.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.255 -1.144 . . . . 0.0 109.361 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.518 ' SG ' ' CD2' ' B' ' 32' ' ' LEU . 12.8 m -69.86 151.18 46.0 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.202 -0.936 . . . . 0.0 109.904 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.474 ' HB3' ' HG3' ' B' ' 72' ' ' GLU . 4.5 t70 -112.46 171.29 7.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -0.856 . . . . 0.0 108.724 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.36 -53.0 59.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.225 -0.922 . . . . 0.0 110.491 -179.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.425 ' OE1' ' OD2' ' B' ' 69' ' ' ASP . 0.0 OUTLIER -56.61 -26.65 56.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.151 -0.968 . . . . 0.0 109.269 -179.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.474 ' HG3' ' HB3' ' B' ' 69' ' ' ASP . 6.5 mt-10 -85.58 -22.66 27.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 109.831 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.531 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 50.8 t80 -74.28 -40.41 62.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.09 -1.006 . . . . 0.0 108.943 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.544 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -75.6 -41.12 55.33 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.48 -0.762 . . . . 0.0 109.196 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.95 71.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.15 -0.969 . . . . 0.0 108.861 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.596 ' CE1' HG12 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -66.08 -63.37 1.1 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.449 -0.782 . . . . 0.0 108.944 179.691 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.578 HG21 ' CD2' ' B' ' 76' ' ' PHE . 52.2 t -57.83 -26.78 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.189 -0.944 . . . . 0.0 109.351 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.521 ' CB ' ' HA ' ' A' ' 71' ' ' GLN . . . -67.09 -34.49 77.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.345 -0.847 . . . . 0.0 109.472 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 0.3 OUTLIER -82.86 -69.4 0.63 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 109.659 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.533 ' CG1' ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.88 -23.78 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.549 -1.345 . . . . 0.0 109.334 -179.413 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 12.0 m -78.42 -67.74 0.71 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.561 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -78.22 -49.54 13.57 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.136 -0.977 . . . . 0.0 108.874 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.561 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.83 -36.38 0.11 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.769 -0.582 . . . . 0.0 109.82 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.3 t -90.03 -36.94 14.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.202 -0.936 . . . . 0.0 109.438 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' B' ' 82' ' ' THR . 60.3 t60 -62.33 -12.95 23.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.95 -31.3 23.66 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.2 -0.938 . . . . 0.0 109.406 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.421 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 16.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.31 -77.54 0.11 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.457 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.526 ' HB2' ' CG ' ' B' ' 39' ' ' GLU . 7.3 mp -66.91 -15.53 63.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.447 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.454 ' O ' ' HG2' ' A' ' 7' ' ' MET . 0.1 OUTLIER -73.65 -63.02 1.29 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.378 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HD2' ' O ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -63.08 -34.18 77.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.249 -0.907 . . . . 0.0 109.356 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' B' ' 6' ' ' ALA . . . -66.44 -66.92 0.49 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 0.0 109.549 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.525 ' O ' ' CD1' ' A' ' 11' ' ' ILE . 6.8 ptm -43.93 -31.78 0.96 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.4 -55.65 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.513 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' B' ' 2' ' ' GLU . . . -63.42 -57.72 9.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.504 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.627 ' CD2' ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -44.04 -37.96 3.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 109.372 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.525 ' CD1' ' O ' ' A' ' 7' ' ' MET . 32.9 mt -64.64 -45.8 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.937 . . . . 0.0 109.36 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -58.27 -23.68 56.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.282 -0.886 . . . . 0.0 109.302 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.611 ' CG1' ' CZ ' ' A' ' 73' ' ' PHE . 0.9 OUTLIER -83.47 -38.6 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.264 -0.898 . . . . 0.0 109.398 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 9.0 t80 -59.56 -51.96 67.58 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 120.92 -1.112 . . . . 0.0 109.425 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -55.16 14.88 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.562 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -46.09 -69.47 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.221 -0.924 . . . . 0.0 109.605 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.572 ' CE1' ' HG ' ' A' ' 35' ' ' LEU . 41.3 m-85 -50.2 -27.67 6.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.248 -0.908 . . . . 0.0 109.561 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.484 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -62.52 -44.9 95.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 109.427 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.523 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -55.27 -18.52 14.05 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 27.8 mmm180 -68.14 -41.87 81.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.308 -1.113 . . . . 0.0 109.419 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.568 ' CG ' ' CD ' ' A' ' 28' ' ' LYS . 2.7 tm-20 -82.23 161.24 22.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.318 -0.864 . . . . 0.0 109.433 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -45.52 -51.04 10.11 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -94.97 167.33 11.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.232 -1.158 . . . . 0.0 109.402 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 11.4 mttt -118.13 86.96 2.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.294 -0.879 . . . . 0.0 109.522 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.9 t-80 -170.08 -35.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.911 . . . . 0.0 109.624 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 5.7 mtmt -140.05 170.11 16.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.504 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 82.5 mt -107.05 170.09 8.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.284 -0.885 . . . . 0.0 109.497 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.568 ' CD ' ' CG ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -128.97 73.59 1.52 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.141 -0.974 . . . . 0.0 109.917 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 5.6 ttmt 62.35 -84.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.442 -0.786 . . . . 0.0 110.696 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.465 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.8 OUTLIER -43.81 -50.53 7.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.115 -0.991 . . . . 0.0 110.567 -179.058 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 6.1 mm-40 -52.69 -40.89 63.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.972 -1.08 . . . . 0.0 109.513 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.572 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 14.2 mt -58.92 -65.89 0.59 Allowed 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.623 -0.673 . . . . 0.0 109.631 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.52 ' CA ' HG13 ' A' ' 36' ' ' ILE . 7.1 ttpp -38.47 -37.64 0.32 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.578 -0.701 . . . . 0.0 110.016 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.448 ' O ' ' OD1' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -65.9 -50.29 65.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -0.939 . . . . 0.0 109.474 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HG ' ' CE1' ' A' ' 17' ' ' TYR . 1.3 mt -60.93 -21.53 63.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 0.0 109.783 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.585 HG12 ' CE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -78.25 -57.97 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.166 -0.959 . . . . 0.0 109.575 -179.75 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.418 ' OD1' HD13 ' A' ' 47' ' ' ILE . 70.3 m-80 -70.1 -5.18 25.1 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.19 -0.944 . . . . 0.0 109.67 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 34' ' ' GLU . 6.5 m120 -114.39 -8.75 12.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.186 -0.946 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.559 ' CG ' ' CB ' ' B' ' 3' ' ' LEU . 1.8 tm-20 -94.25 -46.91 6.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.175 -0.953 . . . . 0.0 109.584 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.507 HD23 ' N ' ' A' ' 40' ' ' LEU . 2.9 mm? -72.9 -52.35 15.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.215 -0.928 . . . . 0.0 109.555 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.428 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.155 -0.965 . . . . 0.0 109.656 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.6 ' CG2' ' CG2' ' A' ' 53' ' ' VAL . 6.1 mt . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -42.5 -34.79 0.9 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.355 -0.841 . . . . 0.0 109.444 179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HB3' ' O ' ' A' ' 48' ' ' LYS . 14.1 pt-20 178.37 -31.72 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.449 -0.782 . . . . 0.0 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.459 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 1.2 pt20 -159.72 29.98 0.19 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.266 -0.896 . . . . 0.0 109.759 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.79 -70.86 0.16 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.033 -1.042 . . . . 0.0 108.802 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.528 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 2.5 t -90.96 -12.72 9.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.6 ' CG2' ' CG2' ' A' ' 47' ' ' ILE . 0.7 OUTLIER -76.91 -30.27 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 50' ' ' GLN . 22.6 t70 -76.24 -47.18 24.85 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.278 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -50.54 63.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.296 -0.878 . . . . 0.0 109.394 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 24.0 m -57.78 -47.31 86.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.114 -0.991 . . . . 0.0 109.58 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.572 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 9.9 tpt -38.21 -49.55 1.37 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.576 -0.702 . . . . 0.0 110.349 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -60.02 -46.1 90.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.12 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.438 HG21 ' O ' ' A' ' 59' ' ' THR . 28.6 m -73.18 -8.76 57.21 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.443 -0.786 . . . . 0.0 109.856 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 56' ' ' VAL . 1.9 mt -84.78 -27.68 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.166 -0.959 . . . . 0.0 109.324 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -43.73 110.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.537 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.521 ' CB ' ' OD1' ' A' ' 69' ' ' ASP . 33.2 t30 -60.1 -52.05 67.0 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.3 -0.875 . . . . 0.0 109.42 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -152.57 18.12 0.62 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.224 -0.922 . . . . 0.0 109.519 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.79 88.53 1.77 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.28 -36.66 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.301 -1.117 . . . . 0.0 108.525 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.2 -1.23 31.26 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -99.83 121.7 41.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.213 -1.169 . . . . 0.0 109.483 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -69.51 131.28 44.47 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.521 ' OD1' ' CB ' ' A' ' 62' ' ' ASN . 2.2 m-20 -110.27 170.66 7.93 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.579 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 1.2 t80 -52.96 -50.63 63.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.071 -1.018 . . . . 0.0 110.406 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.478 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 10.2 mt-30 -51.92 -46.48 64.66 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.501 -0.749 . . . . 0.0 109.752 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.496 ' OE1' HD21 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -74.38 -18.6 60.65 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.095 -1.003 . . . . 0.0 109.695 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.627 ' CE2' ' CD2' ' A' ' 10' ' ' LEU . 10.5 t80 -63.17 -53.95 45.31 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.045 -1.034 . . . . 0.0 109.235 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.54 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.69 -46.21 66.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.528 ' HB1' ' CB ' ' B' ' 75' ' ' ALA . . . -56.18 -31.54 63.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.038 -1.039 . . . . 0.0 109.04 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.585 ' CE1' HG12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -64.6 -65.05 0.73 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.549 ' CG2' ' CE2' ' A' ' 76' ' ' PHE . 41.3 t -56.55 -18.71 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.532 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -65.46 -48.92 71.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.353 -0.842 . . . . 0.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.568 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.9 OUTLIER -74.98 -64.16 1.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.354 -0.841 . . . . 0.0 109.745 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.557 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -48.01 -22.01 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 O-C-N 120.407 -1.433 . . . . 0.0 109.627 -178.824 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.502 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 4.6 m -80.62 -65.8 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.91 -1.119 . . . . 0.0 108.876 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.7 t -80.1 -49.7 11.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.158 -0.963 . . . . 0.0 108.922 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.573 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -37.68 -33.77 0.08 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.607 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 82' ' ' THR . 11.9 t -74.17 -50.89 17.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.354 -0.841 . . . . 0.0 109.351 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -53.44 -55.69 23.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.922 . . . . 0.0 109.45 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -38.55 83.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 0.0 109.471 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -58.25 -75.13 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.254 -0.903 . . . . 0.0 109.66 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.559 ' CB ' ' CG ' ' A' ' 39' ' ' GLU . 1.3 mt -75.58 -30.6 59.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 0.0 109.651 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 7' ' ' MET . 16.9 mt-10 -57.36 -59.1 5.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -0.954 . . . . 0.0 109.301 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' B' ' 1' ' ' SER . 1.0 OUTLIER -60.71 -49.66 76.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.291 -0.881 . . . . 0.0 109.378 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 6' ' ' ALA . . . -66.0 -9.83 33.99 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.274 -0.891 . . . . 0.0 109.449 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' B' ' 3' ' ' LEU . 2.6 ttp -80.71 -53.84 6.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.436 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.97 -36.44 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.373 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.12 -46.72 64.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.203 -0.936 . . . . 0.0 109.469 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.498 ' HB3' ' CE ' ' B' ' 74' ' ' MET . 6.3 mt -61.3 -66.84 0.47 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.903 . . . . 0.0 109.427 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.447 HD13 ' HG3' ' B' ' 7' ' ' MET . 61.3 mt -41.76 -40.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.402 -0.811 . . . . 0.0 109.327 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 29.7 t70 -58.59 -54.06 51.37 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.26 -0.9 . . . . 0.0 109.066 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.536 HG11 ' CE1' ' B' ' 73' ' ' PHE . 1.7 t -51.5 -25.94 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.375 -0.828 . . . . 0.0 109.504 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 10.0 t80 -72.08 -46.39 57.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.897 -1.127 . . . . 0.0 109.666 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.506 ' NE2' ' HD3' ' B' ' 24' ' ' LYS . 43.9 t-80 -78.04 -14.68 59.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.262 -0.899 . . . . 0.0 110.454 -179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.525 ' O ' ' CG ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -90.41 -60.16 2.0 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.947 -1.096 . . . . 0.0 109.287 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.579 ' CD2' ' OE1' ' B' ' 34' ' ' GLU . 24.6 m-85 -61.63 -33.23 73.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.522 -0.736 . . . . 0.0 109.623 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.52 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 4.2 p -82.87 -11.35 58.28 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.172 -0.955 . . . . 0.0 109.658 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.445 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -102.77 9.31 55.26 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.525 ' CG ' ' O ' ' B' ' 16' ' ' GLN . 11.0 mtp85 -89.98 -33.95 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -1.159 . . . . 0.0 109.476 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.468 ' HB2' ' HD3' ' B' ' 28' ' ' LYS . 5.6 pt-20 -170.17 117.44 0.55 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.905 . . . . 0.0 109.384 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.54 -81.13 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' B' ' 24' ' ' LYS . 3.2 p30 -171.57 28.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -1.147 . . . . 0.0 109.555 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.506 ' HD3' ' NE2' ' B' ' 15' ' ' HIS . 1.6 ttmt 43.65 61.2 2.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.893 . . . . 0.0 109.508 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.5 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.2 OUTLIER -170.1 -34.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 0.0 109.678 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -141.12 165.25 28.05 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.203 -0.935 . . . . 0.0 109.708 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.543 ' CD1' ' CD2' ' B' ' 32' ' ' LEU . 17.8 mt -87.77 148.76 24.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.303 -0.873 . . . . 0.0 109.262 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -116.55 72.64 0.82 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.688 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.463 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 62.32 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.461 -0.775 . . . . 0.0 110.578 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.455 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 0.3 OUTLIER -48.32 -37.52 16.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.197 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' B' ' 34' ' ' GLU . 66.9 mm-40 -58.27 -41.22 83.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.085 -1.009 . . . . 0.0 109.48 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.543 ' CD2' ' CD1' ' B' ' 27' ' ' LEU . 18.8 mt -64.46 -57.13 10.11 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.524 -0.735 . . . . 0.0 109.496 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.583 ' CD ' ' CG1' ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.89 -68.78 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.252 -0.905 . . . . 0.0 110.055 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.579 ' OE1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -42.74 -49.82 5.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 109.779 -179.421 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.571 HD11 ' CZ ' ' B' ' 17' ' ' TYR . 14.1 tp -49.12 -47.54 45.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.004 -1.06 . . . . 0.0 109.555 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.531 ' O ' ' CB ' ' B' ' 40' ' ' LEU . 2.9 mt -63.84 -32.66 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' GLU . 9.2 m120 -94.46 -77.33 0.46 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.05 . . . . 0.0 109.731 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.418 ' C ' ' O ' ' B' ' 37' ' ' ASN . 5.0 t-20 -42.68 -26.42 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.329 -0.857 . . . . 0.0 109.902 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.526 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -109.31 -46.24 3.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.084 -1.01 . . . . 0.0 109.922 -179.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.531 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 0.7 OUTLIER -104.89 61.65 0.7 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.065 -1.022 . . . . 0.0 109.503 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.566 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 29.7 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 83.1 -42.73 0.1 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.686 -0.634 . . . . 0.0 109.725 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.0 OUTLIER 179.55 -44.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.139 -0.976 . . . . 0.0 109.203 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.6 OUTLIER 162.36 58.52 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.362 -0.836 . . . . 0.0 109.243 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -90.42 -70.35 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.201 -0.937 . . . . 0.0 109.899 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.546 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.7 t -87.64 -20.89 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.094 -1.004 . . . . 0.0 109.601 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.583 ' CG1' ' CD ' ' B' ' 33' ' ' LYS . 54.7 t -76.9 -29.59 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.955 -1.091 . . . . 0.0 109.224 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.3 OUTLIER -90.11 -29.55 18.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.259 -0.901 . . . . 0.0 109.546 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -35.18 35.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.632 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.546 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 11.1 m -58.63 -47.08 89.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 O-C-N 121.13 -0.981 . . . . 0.0 109.919 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.517 ' HE3' ' CD1' ' B' ' 32' ' ' LEU . 8.2 tpp -42.01 -28.33 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.014 -1.054 . . . . 0.0 109.14 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 1.7 mp0 -80.71 -45.39 17.19 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.457 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.6 m -73.53 -67.21 0.61 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.405 -0.809 . . . . 0.0 109.39 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.574 HD12 ' CD1' ' B' ' 76' ' ' PHE . 2.6 mt -40.61 -33.87 0.31 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.481 -0.762 . . . . 0.0 109.341 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 57' ' ' MET . 4.7 t0 -90.17 83.95 6.06 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.419 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -96.1 26.92 3.9 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.266 -0.896 . . . . 0.0 109.577 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . 0.448 ' OD2' ' OD2' ' B' ' 69' ' ' ASP . 13.1 m-20 -127.93 -34.17 2.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 109.5 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.15 91.47 1.34 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 177.04 -32.71 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.219 -1.165 . . . . 0.0 108.669 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.13 26.49 4.9 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.478 ' HB2' ' CG ' ' B' ' 26' ' ' LYS . 23.8 pt-20 -136.43 124.46 22.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.236 -1.155 . . . . 0.0 109.374 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.529 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 12.8 m -69.57 166.05 19.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.188 -0.945 . . . . 0.0 110.009 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.453 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.6 OUTLIER -129.21 172.23 11.66 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.549 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -61.27 -52.66 63.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.489 -179.555 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.452 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 0.8 OUTLIER -56.34 -34.77 66.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.133 -0.98 . . . . 0.0 109.225 -179.588 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.535 ' OE1' ' CA ' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -81.49 -20.2 40.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 108.877 179.561 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.565 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 3.9 t80 -65.7 -51.04 62.53 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.532 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -69.11 -46.15 68.41 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.279 -0.888 . . . . 0.0 108.902 179.503 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.528 ' CB ' ' HB1' ' A' ' 75' ' ' ALA . . . -64.74 -18.13 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.171 -0.956 . . . . 0.0 108.87 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.574 ' CD1' HD12 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -72.62 -62.78 1.33 Allowed 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.521 ' O ' ' CG2' ' B' ' 81' ' ' THR . 96.1 t -60.56 -27.58 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.54 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -69.26 -30.58 68.73 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.584 -0.697 . . . . 0.0 109.229 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 2.4 mmm -76.28 -71.05 0.41 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.17 -0.956 . . . . 0.0 108.643 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.528 HG11 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.6 -24.99 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 O-C-N 120.66 -1.275 . . . . 0.0 109.467 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.521 ' CG2' ' O ' ' B' ' 77' ' ' VAL . 4.9 p -75.38 -69.61 0.47 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 0.0 108.547 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.2 m -78.01 -53.6 7.24 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -35.96 -37.04 0.1 Allowed 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.257 0.551 . . . . 0.0 109.851 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' B' ' 82' ' ' THR . 5.2 t -88.2 -38.68 15.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.272 -0.892 . . . . 0.0 109.533 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' B' ' 82' ' ' THR . 3.2 t-160 -55.41 -21.23 14.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.479 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -87.59 -37.93 16.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.923 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 16.0 t80 . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.47 -179.979 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.521 ' HB3' ' CB ' ' B' ' 9' ' ' ALA . 1.9 mp0 -67.17 -73.01 0.15 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.216 -0.927 . . . . 0.0 109.455 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' B' ' 10' ' ' LEU . 0.9 OUTLIER -44.52 -29.73 0.77 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.48 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -52.84 48.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.217 -0.927 . . . . 0.0 109.654 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -62.21 -26.1 68.17 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.209 -0.932 . . . . 0.0 109.494 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -72.94 -24.41 60.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.515 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' B' ' 81' ' ' THR . 6.8 tpt -80.86 -55.84 4.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.482 HG11 ' N ' ' A' ' 9' ' ' ALA . 9.9 p -60.97 -24.39 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.195 -0.941 . . . . 0.0 109.614 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.506 ' CB ' ' HB3' ' B' ' 2' ' ' GLU . . . -77.43 -66.64 0.81 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.558 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.528 ' CD1' ' HE2' ' A' ' 74' ' ' MET . 4.1 mm? -43.82 -50.37 7.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.687 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.522 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 17.9 tt -57.61 -45.61 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 109.604 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.522 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.07 -25.72 59.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.27 -0.894 . . . . 0.0 109.865 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.585 ' CG1' ' CD1' ' A' ' 35' ' ' LEU . 2.7 t -87.08 -28.15 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.1 -1.0 . . . . 0.0 109.725 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 7.1 t80 -66.3 -50.18 64.52 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.919 -1.113 . . . . 0.0 109.389 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -79.33 -31.99 43.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.25 -0.906 . . . . 0.0 109.684 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.4 tt0 -66.22 -65.59 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 109.544 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.581 ' CG ' HD13 ' A' ' 35' ' ' LEU . 19.7 m-85 -56.9 -45.0 82.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.31 -0.869 . . . . 0.0 109.604 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.463 ' O ' ' O ' ' A' ' 23' ' ' ASP . 18.1 m -67.8 -20.55 65.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.179 -0.951 . . . . 0.0 109.56 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.85 -7.79 76.19 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 23.8 mtp180 -70.68 -64.47 0.89 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -1.146 . . . . 0.0 109.482 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.37 170.05 11.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.278 -0.889 . . . . 0.0 109.438 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . -62.03 88.05 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER 162.07 89.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.379 -1.071 . . . . 0.0 109.307 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.42 35.14 0.76 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.259 -0.901 . . . . 0.0 109.672 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -151.13 16.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.191 -0.943 . . . . 0.0 109.682 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -170.31 168.25 8.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.124 -0.985 . . . . 0.0 109.579 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 89.2 mt -120.0 149.99 41.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.437 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.1 OUTLIER -105.33 94.27 5.13 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 -179.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.463 ' O ' HD11 ' A' ' 32' ' ' LEU . 2.0 ttmt 37.01 -84.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.703 -0.623 . . . . 0.0 111.276 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.613 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.8 m -45.18 -46.96 12.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.916 -1.115 . . . . 0.0 109.919 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.527 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -45.38 -46.9 13.45 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.036 -1.04 . . . . 0.0 109.32 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 2.5 mp -60.81 -60.95 2.98 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.592 -0.692 . . . . 0.0 109.247 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.502 ' HD3' ' CG1' ' A' ' 53' ' ' VAL . 1.2 mmmm -38.93 -36.43 0.28 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.508 -0.745 . . . . 0.0 109.748 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -68.44 -61.49 1.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.111 -0.993 . . . . 0.0 109.255 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.595 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 0.1 OUTLIER -41.41 -51.52 3.73 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.697 . . . . 0.0 109.882 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.53 ' HA ' ' CD2' ' A' ' 40' ' ' LEU . 53.9 mt -60.61 -50.94 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 110.435 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.558 ' ND2' ' N ' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -81.75 12.04 4.3 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.972 -1.08 . . . . 0.0 109.955 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.46 ' O ' ' OE1' ' A' ' 39' ' ' GLU . 1.4 t-20 -140.83 12.17 2.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.521 ' HB3' ' CD1' ' B' ' 3' ' ' LEU . 6.8 mm-40 -151.55 -35.7 0.13 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.007 -1.058 . . . . 0.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.576 ' O ' ' CB ' ' A' ' 41' ' ' SER . 2.1 mm? -44.22 -74.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.018 -1.051 . . . . 0.0 109.432 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.576 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 2.1 p . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.525 ' CD1' HG22 ' A' ' 53' ' ' VAL . 3.3 mm . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.29 0.567 . . . . 0.0 109.683 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -44.12 -33.27 1.44 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.501 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 15.7 tt0 -179.85 68.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.513 ' N ' HG23 ' A' ' 47' ' ' ILE . 2.9 mt-30 43.85 56.51 4.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.506 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.14 -69.98 0.69 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.244 -0.91 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.528 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.9 t -89.24 -12.35 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.188 -0.945 . . . . 0.0 109.534 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.525 HG22 ' CD1' ' A' ' 47' ' ' ILE . 95.0 t -82.52 -26.26 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.123 -0.985 . . . . 0.0 109.17 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -87.49 -36.55 17.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.136 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.88 -47.29 15.33 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.378 -0.826 . . . . 0.0 109.209 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.545 HG12 ' CD1' ' A' ' 60' ' ' LEU . 1.5 p -62.96 -43.41 99.0 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 O-C-N 121.194 -0.941 . . . . 0.0 109.253 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.515 ' CE ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -46.09 -42.36 13.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.45 179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -57.62 12.15 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.476 HG21 ' O ' ' A' ' 56' ' ' VAL . 6.0 t -63.6 -12.91 37.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.231 -0.918 . . . . 0.0 109.616 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -79.77 -30.04 40.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -0.858 . . . . 0.0 109.452 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 0.5 OUTLIER -89.92 104.73 17.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -99.94 1.14 42.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.286 -0.884 . . . . 0.0 109.585 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.91 -22.49 6.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.933 . . . . 0.0 109.527 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 85.78 99.21 0.74 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER 167.34 -27.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.272 -1.134 . . . . 0.0 108.622 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.42 -14.59 30.28 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.402 ' OE2' ' N ' ' A' ' 67' ' ' GLU . 2.7 mm-40 -79.61 111.42 15.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -1.097 . . . . 0.0 109.31 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.4 t -69.68 156.55 38.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.88 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.489 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -118.57 171.83 7.91 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.418 -0.801 . . . . 0.0 108.843 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -62.63 -51.54 66.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.17 -0.956 . . . . 0.0 110.194 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.469 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 5.7 mt-30 -56.03 -33.1 64.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 0.0 109.062 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.489 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 1.1 mm-40 -81.79 -22.12 37.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.388 -0.82 . . . . 0.0 109.02 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 37.9 t80 -66.78 -58.03 5.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.393 -0.817 . . . . 0.0 109.1 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.541 ' HB3' ' CB ' ' B' ' 78' ' ' ALA . 4.1 tpt -64.35 -47.96 77.35 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 109.153 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.556 ' CB ' ' CB ' ' B' ' 75' ' ' ALA . . . -57.05 -29.48 63.46 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.157 -0.964 . . . . 0.0 108.686 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.599 ' CE2' ' CG2' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -62.0 -66.19 0.58 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.488 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.599 ' CG2' ' CE2' ' A' ' 76' ' ' PHE . 55.1 t -55.52 -22.2 11.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.532 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -59.79 -49.16 78.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.513 -0.742 . . . . 0.0 109.154 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 20.3 mtp -76.64 -65.67 0.91 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.84 0.829 . . . . 0.0 109.664 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.575 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -47.64 -21.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 120.449 -1.407 . . . . 0.0 110.108 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 21.9 m -83.49 -63.56 1.33 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 0.0 108.612 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.586 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.3 m -79.62 -53.13 7.14 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.562 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -35.26 -33.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.2 0.524 . . . . 0.0 109.946 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.6 t -89.54 -41.96 11.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.476 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.429 ' N ' ' O ' ' A' ' 82' ' ' THR . 13.8 m170 -50.88 -56.44 12.27 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 109.47 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.36 -19.47 65.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.435 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 36.7 t80 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.267 -0.895 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.463 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 20.4 m . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.506 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 3.8 mm-40 -73.08 -55.12 6.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 109.257 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.595 ' CD1' ' CD2' ' A' ' 35' ' ' LEU . 2.8 mt -76.51 -11.52 59.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.847 . . . . 0.0 109.418 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' B' ' 7' ' ' MET . 0.1 OUTLIER -74.61 -54.57 7.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.192 -0.942 . . . . 0.0 108.815 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -20.01 58.79 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.303 -0.873 . . . . 0.0 109.068 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -81.96 -30.47 31.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.388 -0.82 . . . . 0.0 109.568 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.486 ' O ' ' CG1' ' B' ' 11' ' ' ILE . 1.3 ppp? -80.32 -32.01 38.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.133 -0.979 . . . . 0.0 109.392 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.445 ' N ' ' HG3' ' B' ' 7' ' ' MET . 55.4 t -73.09 -49.13 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.127 -0.983 . . . . 0.0 109.17 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.521 ' CB ' ' HB3' ' A' ' 2' ' ' GLU . . . -69.11 -43.91 73.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.346 -0.846 . . . . 0.0 109.613 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' A' ' 3' ' ' LEU . 50.0 mt -61.96 -28.3 69.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.209 -0.932 . . . . 0.0 109.802 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.578 HD12 ' CZ ' ' B' ' 70' ' ' PHE . 5.2 mm -72.16 -43.45 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.374 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.468 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 1.3 t70 -67.8 -36.9 81.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.293 -0.88 . . . . 0.0 110.161 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.602 ' O ' ' CD1' ' B' ' 17' ' ' TYR . 1.3 m -75.03 -34.48 32.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.046 -1.034 . . . . 0.0 110.083 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 69.5 t80 -61.76 -52.23 65.07 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.685 -1.26 . . . . 0.0 109.234 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.429 ' O ' ' C ' ' B' ' 16' ' ' GLN . 29.1 m80 -74.71 -60.46 2.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.25 -0.906 . . . . 0.0 109.755 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.468 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 2.3 tt0 -42.73 -47.21 5.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.287 -0.883 . . . . 0.0 109.684 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.644 ' CD2' ' CD1' ' B' ' 35' ' ' LEU . 3.0 m-85 -58.29 -52.16 66.74 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.207 -0.933 . . . . 0.0 109.056 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.462 ' OG ' HD22 ' B' ' 27' ' ' LEU . 12.2 m -51.86 -27.06 11.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.439 -0.788 . . . . 0.0 109.551 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . -66.95 -41.51 93.26 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 1.3 mmt180 -43.66 -48.51 7.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -1.128 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' B' ' 20' ' ' ARG . 22.0 mt-10 -162.78 148.3 12.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.278 -0.889 . . . . 0.0 109.439 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 87.87 75.98 1.28 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' B' ' 22' ' ' GLY . 2.2 m-20 43.74 -148.8 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.177 -1.19 . . . . 0.0 109.523 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -144.5 68.8 1.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.432 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.3 -38.56 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.918 . . . . 0.0 109.471 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -113.15 169.88 8.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.917 . . . . 0.0 109.401 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.481 ' HB3' ' HB3' ' B' ' 31' ' ' GLU . 12.8 mt -93.97 138.73 31.76 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -0.96 . . . . 0.0 109.612 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.554 ' O ' ' CG ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER -94.46 82.65 4.05 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.382 -0.824 . . . . 0.0 109.504 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 6.8 ttmt 44.43 -91.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.113 -0.992 . . . . 0.0 110.196 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 28' ' ' LYS . 45.0 m -43.22 -36.88 1.92 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.872 -1.143 . . . . 0.0 110.071 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.481 ' HB3' ' HB3' ' B' ' 27' ' ' LEU . 1.4 mp0 -43.04 -51.43 5.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.084 -1.01 . . . . 0.0 110.352 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' B' ' 29' ' ' LYS . 0.3 OUTLIER -74.63 -35.67 62.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.19 -0.944 . . . . 0.0 109.068 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -52.15 -27.67 15.17 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.054 -1.029 . . . . 0.0 108.741 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.512 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -83.32 -52.34 6.64 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.297 -0.877 . . . . 0.0 108.828 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.644 ' CD1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -43.12 -38.96 2.6 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.438 -0.789 . . . . 0.0 108.98 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.539 ' CG2' ' HB2' ' B' ' 40' ' ' LEU . 3.8 mt -78.8 -39.1 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 O-C-N 121.561 -0.712 . . . . 0.0 109.318 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.405 ' O ' ' OG ' ' B' ' 41' ' ' SER . 1.9 m-80 -75.94 -0.25 20.81 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.505 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.26 -53.08 3.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.161 -0.962 . . . . 0.0 109.069 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . 1.0 OUTLIER -105.31 -28.48 10.88 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.001 179.609 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.539 ' HB2' ' CG2' ' B' ' 36' ' ' ILE . 74.3 mt -98.02 56.32 1.22 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.406 -0.809 . . . . 0.0 109.37 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' B' ' 37' ' ' ASN . 11.5 m . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.537 ' CD1' HG23 ' B' ' 36' ' ' ILE . 4.8 mt . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -76.77 3.28 12.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.132 -0.98 . . . . 0.0 109.52 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.49 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 1.2 mm-40 -123.54 14.66 9.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.209 -0.932 . . . . 0.0 108.98 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.524 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 75.04 54.21 0.07 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.397 -0.814 . . . . 0.0 109.546 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.08 -70.8 0.65 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.192 -0.943 . . . . 0.0 109.502 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.54 ' CG1' ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -93.87 -24.31 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.108 -0.995 . . . . 0.0 108.753 179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.527 ' HA ' ' CG2' ' B' ' 56' ' ' VAL . 45.8 t -77.22 -17.23 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.356 -0.84 . . . . 0.0 108.869 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.524 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 41.0 t0 -84.18 -46.71 11.6 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.365 -0.835 . . . . 0.0 109.113 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -71.45 -49.8 38.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.236 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.535 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 21.4 m -54.21 -46.74 68.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.134 -0.978 . . . . 0.0 109.352 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.521 ' HG2' ' CE ' ' B' ' 29' ' ' LYS . 7.4 tpt -43.54 -44.55 6.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 109.719 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -54.43 45.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.209 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.474 HG23 ' O ' ' B' ' 56' ' ' VAL . 4.9 t -71.55 -9.09 57.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 109.542 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.633 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -90.88 -10.83 41.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.37 -0.831 . . . . 0.0 109.459 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.417 ' OD1' ' HE1' ' B' ' 57' ' ' MET . 11.6 m-20 -90.14 82.43 6.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 109.294 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -85.01 13.17 6.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -160.76 27.29 0.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.518 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' OD1' ' B' ' 65' ' ' ASP . . . 49.94 68.5 1.37 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' B' ' 64' ' ' GLY . 0.4 OUTLIER -177.06 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.275 -1.133 . . . . 0.0 108.603 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.12 8.25 25.8 Favored Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 1.4 mt-10 -69.91 85.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -1.136 . . . . 0.0 109.455 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 4.1 m -69.95 140.79 53.07 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.446 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -100.67 172.71 6.92 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.7 OUTLIER -64.97 -58.83 5.1 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.101 -0.999 . . . . 0.0 110.463 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.525 ' CG ' ' HA ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -50.92 -49.67 59.14 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.166 -0.959 . . . . 0.0 109.272 -179.511 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.642 ' CB ' ' CZ ' ' B' ' 76' ' ' PHE . 1.3 mm-40 -68.06 -24.56 65.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.382 -0.824 . . . . 0.0 109.021 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.585 ' CZ ' HD23 ' B' ' 35' ' ' LEU . 1.7 t80 -66.05 -60.75 2.53 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.479 -0.763 . . . . 0.0 109.606 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.532 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 2.6 mtm -53.55 -34.86 59.77 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.0 109.159 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.556 ' CB ' ' CB ' ' A' ' 75' ' ' ALA . . . -68.86 -34.25 75.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.12 -0.987 . . . . 0.0 108.723 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CZ ' ' CB ' ' B' ' 72' ' ' GLU . 20.4 m-30 -65.31 -66.17 0.58 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.527 ' CG1' HD13 ' B' ' 40' ' ' LEU . 57.4 t -47.2 -26.72 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.541 ' CB ' ' HB3' ' A' ' 74' ' ' MET . . . -56.95 -64.72 0.78 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 6.0 mtm -56.86 -61.91 2.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.197 -0.939 . . . . 0.0 109.408 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.54 ' HA ' ' CG1' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.35 -22.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 O-C-N 120.66 -1.275 . . . . 0.0 109.528 -179.183 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.533 ' CG2' ' CE ' ' A' ' 7' ' ' MET . 30.2 m -79.0 -69.46 0.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.929 -1.107 . . . . 0.0 109.055 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.3 t -76.41 -48.89 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.142 -0.974 . . . . 0.0 109.073 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.568 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.91 -35.16 0.09 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.749 -0.594 . . . . 0.0 110.022 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.7 t -89.64 -37.49 14.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -0.964 . . . . 0.0 109.712 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.448 ' O ' ' ND1' ' B' ' 85' ' ' HIS . 1.3 t60 -64.96 -12.12 46.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.205 -0.935 . . . . 0.0 109.551 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.5 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 5.6 pt-20 -90.15 -33.96 16.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 0.0 109.6 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . 0.481 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.5 t80 . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.507 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.448 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 49.7 m . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.515 ' HG3' ' CG2' ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.26 -95.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.895 . . . . 0.0 109.66 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.535 ' HB2' ' CG ' ' B' ' 39' ' ' GLU . 7.3 mp -47.23 -29.31 2.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.1 -1.0 . . . . 0.0 109.739 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.5 OUTLIER -52.14 -60.4 3.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.148 -0.97 . . . . 0.0 109.172 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -35.01 79.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.329 -0.857 . . . . 0.0 109.018 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -69.87 -10.76 59.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.88 -47.61 7.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.303 -0.873 . . . . 0.0 109.196 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.464 ' O ' HG21 ' A' ' 11' ' ' ILE . 52.4 t -64.68 -27.16 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.304 -0.873 . . . . 0.0 109.233 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HB2' ' CA ' ' B' ' 2' ' ' GLU . . . -85.54 -58.29 2.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.341 -0.849 . . . . 0.0 109.366 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.59 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 3.8 mt -49.14 -34.28 13.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 0.0 109.337 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.529 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 3.3 tt -76.21 -46.06 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 109.53 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.529 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -55.12 -21.32 12.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.331 -0.855 . . . . 0.0 109.552 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.608 ' CG1' ' CZ ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -90.13 -39.63 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.141 -0.974 . . . . 0.0 109.674 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 25.3 t80 -53.73 -41.92 67.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.819 -1.175 . . . . 0.0 108.858 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -79.25 -44.43 21.78 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.341 -0.849 . . . . 0.0 109.205 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' A' ' 15' ' ' HIS . 1.7 tt0 -44.4 -38.93 4.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.268 -0.895 . . . . 0.0 108.82 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.615 ' CE2' ' CD2' ' A' ' 35' ' ' LEU . 80.8 m-85 -94.08 -78.04 0.44 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.525 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 24.4 p 39.05 28.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.594 -0.691 . . . . 0.0 110.006 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' TYR . . . 76.9 51.82 6.12 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 17' ' ' TYR . 32.7 mtp180 -40.65 -29.52 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.5 -1.0 . . . . 0.0 109.732 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -98.5 85.89 3.47 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.237 -0.915 . . . . 0.0 109.428 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 103.69 91.87 2.22 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 9.8 t70 70.94 154.97 0.14 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.199 -1.177 . . . . 0.0 109.402 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.525 ' CA ' ' OG ' ' A' ' 18' ' ' SER . 10.9 mttp -134.64 60.44 1.7 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.521 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t-80 -130.42 -35.18 1.54 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.21 -0.931 . . . . 0.0 109.558 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -140.83 167.43 22.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.4 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.534 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 9.0 mt -88.92 170.06 11.03 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.138 -0.976 . . . . 0.0 109.719 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 2.6 ptmm? -138.92 71.12 1.38 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.375 -0.828 . . . . 0.0 109.238 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 64.9 -83.08 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.581 -0.699 . . . . 0.0 110.225 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 91.0 p -41.98 -55.57 3.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.559 ' OE1' ' CD1' ' A' ' 17' ' ' TYR . 2.8 mm-40 -45.92 -45.82 15.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.028 . . . . 0.0 108.717 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.521 ' CD1' ' SD ' ' A' ' 57' ' ' MET . 16.3 mt -52.14 -68.25 0.19 Allowed 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' CG1' ' A' ' 53' ' ' VAL . 19.3 mttt -38.27 -31.08 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.558 -0.714 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 31' ' ' GLU . 7.9 mm-40 -67.45 -67.61 0.44 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.085 -1.01 . . . . 0.0 109.169 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.615 ' CD2' ' CE2' ' A' ' 17' ' ' TYR . 18.6 mt -43.85 -45.69 7.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.337 -0.852 . . . . 0.0 109.461 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.626 ' CD1' ' CE1' ' A' ' 76' ' ' PHE . 44.7 mm -54.05 -62.0 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.384 -0.822 . . . . 0.0 109.672 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.411 ' C ' ' OD1' ' A' ' 38' ' ' ASN . 10.8 m120 -83.08 16.7 2.25 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.34 -0.85 . . . . 0.0 110.162 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m120 -142.06 16.94 2.1 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.037 -1.04 . . . . 0.0 109.742 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.548 ' HG3' ' N ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -158.4 -33.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.955 -1.091 . . . . 0.0 110.563 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.548 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 2.0 mm? -53.49 -68.94 0.13 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.926 -1.109 . . . . 0.0 109.644 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.499 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.521 HD11 ' CG2' ' A' ' 53' ' ' VAL . 1.2 mt . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 17.1 ptpt -40.1 -35.44 0.39 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.463 -0.773 . . . . 0.0 109.873 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 11.8 pt-20 178.13 -31.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.855 . . . . 0.0 109.435 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.54 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mt-30 165.17 50.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.328 -0.857 . . . . 0.0 109.147 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -90.32 -70.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.895 . . . . 0.0 110.135 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.547 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 0.7 OUTLIER -86.2 -23.37 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.127 -0.983 . . . . 0.0 109.954 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.521 ' CG2' HD11 ' A' ' 47' ' ' ILE . 83.7 t -81.69 -32.16 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 120.793 -1.192 . . . . 0.0 109.405 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.54 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -90.58 -28.35 18.52 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.188 -0.945 . . . . 0.0 109.499 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 10.3 tptm -87.34 -42.48 12.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.713 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.569 HG12 ' CE1' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -73.93 -29.8 26.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.118 -0.989 . . . . 0.0 109.127 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.554 ' N ' HG11 ' A' ' 56' ' ' VAL . 6.9 tpt -49.42 -39.33 32.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.359 -0.838 . . . . 0.0 109.48 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.33 -48.2 20.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.859 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.479 HG22 ' CE ' ' A' ' 79' ' ' MET . 3.9 t -66.1 -9.53 31.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.583 HD12 ' CZ ' ' A' ' 76' ' ' PHE . 35.2 mt -82.68 -52.83 6.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 109.347 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.515 ' OD2' ' CE ' ' A' ' 57' ' ' MET . 1.0 OUTLIER -75.76 86.9 2.77 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.49 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.64 25.72 2.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 109.428 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -121.8 -27.76 4.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.46 94.67 1.02 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.7 -31.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.267 -1.137 . . . . 0.0 108.576 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.11 -23.91 19.92 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.524 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 4.8 mm-40 -83.94 136.7 33.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.22 -1.165 . . . . 0.0 109.409 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.479 ' HB3' ' OE1' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -71.84 170.47 13.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.223 -0.923 . . . . 0.0 109.927 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 69' ' ' ASP . 0.4 OUTLIER -136.78 171.4 14.56 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.5 OUTLIER -61.4 -62.2 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.799 -1.188 . . . . 0.0 110.354 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.532 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 0.9 OUTLIER -47.79 -28.67 2.66 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.034 -1.041 . . . . 0.0 108.918 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.534 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -73.22 -43.13 61.77 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.548 -0.72 . . . . 0.0 109.64 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.608 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 29.2 t80 -56.24 -54.36 46.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.875 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.538 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -56.4 -58.19 9.08 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.047 -1.033 . . . . 0.0 109.344 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.496 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -57.75 -17.38 15.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.2 -0.938 . . . . 0.0 108.975 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.626 ' CE1' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.66 -70.43 0.32 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.457 -0.777 . . . . 0.0 109.138 179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.522 ' CG1' ' OE2' ' A' ' 39' ' ' GLU . 46.5 t -52.23 -29.52 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.427 -0.795 . . . . 0.0 109.188 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.525 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -64.22 -41.95 96.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.28 -0.888 . . . . 0.0 109.709 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.558 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 18.3 mtm -78.19 -70.42 0.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 109.73 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.526 HG11 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -43.82 -23.96 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.472 -1.393 . . . . 0.0 109.695 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.502 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.8 m -80.34 -68.13 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.0 108.871 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.2 t -77.51 -49.3 15.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.181 -0.949 . . . . 0.0 108.796 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.571 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.05 -43.34 0.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.05 -28.76 18.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.314 -0.866 . . . . 0.0 109.607 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -69.65 -9.69 55.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.907 . . . . 0.0 109.592 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.44 -10.16 50.08 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.203 -0.936 . . . . 0.0 109.497 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 0.0 109.547 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.424 ' HB3' ' HB2' ' B' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.471 ' CA ' ' HB2' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -59.68 -72.53 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.196 -0.94 . . . . 0.0 109.833 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.59 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 3.6 mm? -73.69 -31.64 63.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.0 109.89 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.424 ' HB2' ' HB3' ' B' ' 1' ' ' SER . 3.3 tt0 -56.97 -58.92 6.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.212 -0.93 . . . . 0.0 109.389 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -64.36 -31.09 72.16 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.86 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -75.97 -14.01 60.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.0 109.507 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.409 ' HE2' ' O ' ' A' ' 40' ' ' LEU . 2.4 mtp -86.87 -37.75 17.4 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 24.6 t -73.83 -34.64 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -0.907 . . . . 0.0 109.397 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.76 -43.27 37.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.663 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.575 HD11 ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -66.47 -55.46 15.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 45.0 mt -52.35 -47.8 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -0.858 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -63.16 -33.74 76.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.607 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.595 ' CG1' ' CD1' ' B' ' 35' ' ' LEU . 0.9 OUTLIER -73.53 -15.69 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.224 -0.923 . . . . 0.0 109.339 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.555 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 13.4 t80 -82.89 -44.98 14.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.965 -1.084 . . . . 0.0 108.981 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.456 ' O ' ' OG ' ' B' ' 18' ' ' SER . 75.1 m-70 -66.24 -31.21 71.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.411 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 4.2 tt0 -81.04 -50.46 9.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.158 -0.964 . . . . 0.0 109.407 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.527 ' O ' ' CD2' ' B' ' 27' ' ' LEU . 10.0 m-85 -78.68 4.03 14.8 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.308 -0.87 . . . . 0.0 109.574 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.536 ' HA ' ' CD2' ' B' ' 27' ' ' LEU . 2.1 p -83.36 41.45 0.77 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.194 -0.941 . . . . 0.0 109.76 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . 103.99 55.67 0.77 Allowed Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' B' ' 16' ' ' GLN . 11.9 mtp85 -45.02 -26.39 0.43 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.31 -1.112 . . . . 0.0 109.132 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -132.06 117.22 18.08 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.327 -0.858 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.04 -109.62 3.76 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -63.62 178.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 109.421 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' B' ' 18' ' ' SER . 15.4 ttmm -161.51 56.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.512 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -161.64 -36.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.587 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' B' ' 68' ' ' CYS . 33.1 mtmt -131.67 170.16 15.16 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.144 -0.972 . . . . 0.0 109.481 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.536 ' CD2' ' HA ' ' B' ' 18' ' ' SER . 4.0 mt -95.29 142.9 27.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.172 -0.955 . . . . 0.0 109.918 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.523 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 9.4 pttp -124.32 74.29 1.3 Allowed 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.418 -0.801 . . . . 0.0 108.874 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 4.6 tppt? 68.3 -81.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.692 -0.63 . . . . 0.0 110.283 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -49.47 -46.02 47.52 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.083 -1.011 . . . . 0.0 110.406 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' CG ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -58.18 -34.64 70.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.0 -1.062 . . . . 0.0 109.618 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.528 ' CD2' HD21 ' B' ' 60' ' ' LEU . 12.1 mt -67.98 -69.57 0.31 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.478 -0.763 . . . . 0.0 109.51 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 8.8 mtpt -40.76 -27.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.396 -0.815 . . . . 0.0 110.171 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.498 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.5 OUTLIER -76.91 -58.75 3.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.034 -1.041 . . . . 0.0 109.424 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.595 ' CD1' ' CG1' ' B' ' 13' ' ' VAL . 23.4 tp -41.37 -47.16 3.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.641 ' CD1' ' CE2' ' B' ' 76' ' ' PHE . 1.3 mp -78.16 -38.95 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.0 110.082 -179.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' B' ' 33' ' ' LYS . 2.1 m-80 -80.29 4.53 17.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.927 -1.108 . . . . 0.0 110.044 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.464 ' OD1' ' OE1' ' B' ' 34' ' ' GLU . 1.0 OUTLIER -126.68 -16.08 5.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.09 -1.006 . . . . 0.0 109.937 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.535 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 64.9 mm-40 -123.86 -9.74 7.76 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.109 -0.995 . . . . 0.0 109.633 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.522 ' CD1' ' HB ' ' B' ' 80' ' ' VAL . 37.0 mt -117.29 67.17 0.74 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.199 -0.938 . . . . 0.0 109.685 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 O-C-N 121.336 -0.852 . . . . 0.0 109.087 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.564 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 24.6 mm . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 5.8 mttt 83.09 -42.67 0.1 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.692 -0.63 . . . . 0.0 109.713 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.8 OUTLIER 164.52 -25.26 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.097 -1.002 . . . . 0.0 109.368 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 165.11 51.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.265 -0.897 . . . . 0.0 109.574 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.46 ' OE1' ' HE3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.14 -70.66 0.66 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.135 -0.978 . . . . 0.0 109.558 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.527 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.4 t -90.85 -24.79 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.231 -0.918 . . . . 0.0 108.982 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.517 HG22 ' CD1' ' B' ' 47' ' ' ILE . 69.7 t -72.39 -22.22 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.283 -0.885 . . . . 0.0 108.928 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.475 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 7.6 t70 -86.91 -53.47 4.88 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.302 -0.874 . . . . 0.0 109.111 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.47 -42.52 78.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.287 -0.883 . . . . 0.0 109.122 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.527 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 35.2 m -61.85 -47.36 93.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 O-C-N 121.235 -0.915 . . . . 0.0 109.196 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.441 ' C ' ' O ' ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.08 -27.62 0.22 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.4 OUTLIER -77.58 -47.44 19.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.336 -0.853 . . . . 0.0 108.699 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.454 ' O ' ' C ' ' B' ' 60' ' ' LEU . 9.2 m -76.26 -66.44 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.378 -0.826 . . . . 0.0 109.095 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.649 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 1.5 mp -39.9 -30.16 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.51 -0.744 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' B' ' 59' ' ' THR . 48.9 t0 -90.21 110.68 21.71 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.232 -0.918 . . . . 0.0 109.425 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -141.98 25.5 1.93 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -0.955 . . . . 0.0 109.531 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.62 -15.54 8.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 90.33 55.31 1.97 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 8.0 t70 179.28 -33.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.228 -1.16 . . . . 0.0 108.634 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.426 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.1 34.34 2.37 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.451 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 7.2 mm-40 -104.87 114.44 28.64 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -1.147 . . . . 0.0 109.434 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.483 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 12.0 t -70.1 158.31 35.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.278 -0.889 . . . . 0.0 109.617 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.483 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.8 OUTLIER -132.05 171.18 13.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.405 -0.809 . . . . 0.0 108.924 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.426 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.1 OUTLIER -53.2 -48.36 68.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.321 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.4 ' O ' ' HB1' ' B' ' 75' ' ' ALA . 2.0 pt20 -59.27 -36.01 74.75 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.345 -0.847 . . . . 0.0 108.826 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.469 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 0.6 OUTLIER -82.23 -12.34 58.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.409 -0.807 . . . . 0.0 109.217 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.575 ' CE2' HD11 ' B' ' 10' ' ' LEU . 3.8 t80 -73.11 -57.92 3.68 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.525 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 46.4 mtt -68.31 -44.33 75.66 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.388 -0.82 . . . . 0.0 109.332 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.496 ' HB1' ' CB ' ' A' ' 75' ' ' ALA . . . -59.82 -40.6 89.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -0.876 . . . . 0.0 109.406 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.649 ' CD2' ' CD2' ' B' ' 60' ' ' LEU . 1.2 t80 -57.43 -68.73 0.21 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.271 -0.893 . . . . 0.0 109.131 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.494 ' O ' ' CB ' ' B' ' 81' ' ' THR . 71.2 t -52.45 -22.69 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.538 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -62.07 -50.87 70.25 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.56 -0.713 . . . . 0.0 109.206 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.562 ' O ' ' N ' ' B' ' 83' ' ' ALA . 29.7 mtp -74.01 -66.92 0.66 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.43 -0.794 . . . . 0.0 109.366 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.64 ' CG2' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -42.59 -25.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.502 -1.374 . . . . 0.0 109.631 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.494 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 5.9 m -78.63 -70.01 0.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.982 -1.074 . . . . 0.0 108.722 178.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.562 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.1 t -77.82 -49.07 15.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.226 -0.921 . . . . 0.0 108.765 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' B' ' 79' ' ' MET . . . -39.39 -44.09 1.29 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.684 -0.635 . . . . 0.0 109.543 179.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 46.4 t -73.27 -40.37 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.861 . . . . 0.0 109.478 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.17 -13.49 48.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.22 -0.925 . . . . 0.0 109.398 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -77.23 -40.57 44.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.46 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.444 ' HG2' ' CB ' ' B' ' 9' ' ' ALA . 41.4 tt0 -80.29 -61.75 1.88 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.446 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.527 HD13 ' CD1' ' B' ' 10' ' ' LEU . 12.1 tp -64.43 -11.09 29.75 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.269 -0.895 . . . . 0.0 109.473 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -89.16 -53.32 4.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.243 -0.911 . . . . 0.0 109.411 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.86 -27.28 63.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.911 . . . . 0.0 109.373 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -70.2 -32.67 70.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.412 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.467 ' HE2' ' HG ' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -71.33 -43.33 67.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.46 ' O ' HG21 ' A' ' 11' ' ' ILE . 9.0 t -71.45 -28.4 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.0 109.656 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -78.39 -68.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.927 . . . . 0.0 109.581 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.579 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 81.4 mt -43.71 -48.51 7.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.591 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.522 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -58.97 -44.45 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.867 . . . . 0.0 109.633 -179.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.522 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 5.8 t70 -66.65 -19.2 65.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 110.063 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.579 HG11 ' CD1' ' A' ' 17' ' ' TYR . 2.7 t -88.58 -29.51 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.03 -1.044 . . . . 0.0 109.607 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -71.33 -46.06 61.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.824 -1.172 . . . . 0.0 109.12 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.403 ' CD2' ' HG2' ' A' ' 24' ' ' LYS . 16.4 t-80 -77.8 -34.71 51.99 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.538 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -68.94 -63.83 0.98 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.919 . . . . 0.0 109.418 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.628 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 36.7 m-85 -53.73 -38.52 64.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.251 -0.905 . . . . 0.0 109.435 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 18.7 m -68.39 -30.97 70.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.17 -0.956 . . . . 0.0 109.492 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.461 ' HA2' ' HG3' ' A' ' 24' ' ' LYS . . . -57.22 -19.06 30.6 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.6 mmt180 -72.3 -38.06 68.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.248 -1.148 . . . . 0.0 109.444 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -78.26 164.15 25.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.242 -0.912 . . . . 0.0 109.491 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -50.51 -51.91 30.65 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.458 ' HB2' ' OE2' ' A' ' 21' ' ' GLU . 42.5 m-20 -78.17 -173.35 3.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -1.169 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HG3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -142.08 56.06 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 109.449 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.506 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 76.0 t60 -169.99 32.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 109.483 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 9.2 ptpt -170.03 170.31 7.61 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.197 -0.94 . . . . 0.0 109.524 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 87.4 mt -134.64 129.96 35.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 109.78 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -78.75 166.51 22.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.181 -0.95 . . . . 0.0 108.763 179.266 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.478 ' CG ' ' SD ' ' A' ' 57' ' ' MET . 11.3 mttt -42.65 -27.22 0.16 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 0.0 109.672 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -77.59 -58.38 3.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.968 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.53 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 16.6 mm-40 -46.76 -42.83 17.5 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.087 -1.008 . . . . 0.0 109.296 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.522 ' CD2' HD11 ' A' ' 60' ' ' LEU . 1.7 mp -59.03 -65.87 0.6 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.558 -0.714 . . . . 0.0 109.204 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.581 ' CG ' ' CG1' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -41.58 -32.09 0.33 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.311 -0.868 . . . . 0.0 109.685 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -67.48 -61.73 1.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.212 -0.93 . . . . 0.0 109.468 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.628 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 2.0 mm? -40.92 -51.35 3.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.912 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.563 HG13 ' CZ ' ' A' ' 76' ' ' PHE . 46.6 mt -62.07 -44.17 98.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 110.025 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.462 ' OD1' HG12 ' A' ' 47' ' ' ILE . 72.7 m-20 -88.13 9.93 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.0 109.954 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 1.7 t-20 -105.62 -26.39 11.87 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.118 -0.989 . . . . 0.0 109.085 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.53 ' HG3' ' CB ' ' B' ' 3' ' ' LEU . 0.0 OUTLIER -134.88 -35.3 0.87 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.405 -0.809 . . . . 0.0 109.547 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.563 ' CD1' ' N ' ' A' ' 40' ' ' LEU . 7.8 mp -86.32 15.1 5.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.569 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.599 ' O ' ' N ' ' A' ' 49' ' ' GLU . 34.8 mm . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.505 ' CG ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 43.81 -81.99 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.933 0.873 . . . . 0.0 110.478 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 47' ' ' ILE . 13.4 mm-40 -46.02 -33.55 3.47 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.522 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.3 tt0 76.4 32.88 0.56 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 109.351 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 3.3 mm-40 -72.69 -49.49 31.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.529 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 0.3 OUTLIER -91.52 -18.16 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.197 -0.939 . . . . 0.0 109.37 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.581 ' CG1' ' CG ' ' A' ' 33' ' ' LYS . 25.1 t -82.0 -37.84 15.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 120.793 -1.192 . . . . 0.0 109.022 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.09 -29.66 17.18 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.983 -1.073 . . . . 0.0 109.3 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 25.1 tttm -90.91 -35.51 14.69 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.321 -0.862 . . . . 0.0 110.559 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.541 ' CG1' HD13 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -90.52 -25.64 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 120.846 -1.159 . . . . 0.0 110.361 -178.924 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.532 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -71.96 -49.62 35.78 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.848 -1.157 . . . . 0.0 109.22 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -35.84 74.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.12 -0.988 . . . . 0.0 108.82 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.457 ' CG2' ' HA ' ' A' ' 56' ' ' VAL . 5.6 t -90.31 -9.83 46.35 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.443 -0.785 . . . . 0.0 109.422 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.576 HD12 ' CD1' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -65.89 -45.96 80.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.368 -0.833 . . . . 0.0 109.448 -179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.452 ' OD2' ' HE3' ' A' ' 57' ' ' MET . 9.0 m-20 -61.34 88.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.42 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -71.63 -10.27 59.52 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 0.0 109.504 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.78 -37.29 10.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.516 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 97.78 93.37 1.93 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 39.1 t0 178.61 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.269 -1.136 . . . . 0.0 108.658 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.444 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 110.18 19.08 8.24 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 26' ' ' LYS . 53.5 mt-10 -127.15 129.25 47.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -1.137 . . . . 0.0 109.47 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.46 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 8.6 t -69.74 155.54 40.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.639 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.503 ' N ' ' OD1' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -126.17 171.44 10.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.453 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -61.47 -50.46 72.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.124 -0.985 . . . . 0.0 110.501 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 2.8 pt20 -58.4 -40.09 81.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.947 . . . . 0.0 108.836 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 1.1 tt0 -80.6 -12.24 59.54 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.571 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 19.3 t80 -69.94 -51.99 28.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.197 -0.94 . . . . 0.0 108.503 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.533 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 26.9 mtt -68.98 -43.47 74.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.522 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -67.33 -20.32 65.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 108.652 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' A' ' 60' ' ' LEU . 1.1 t80 -68.13 -57.95 5.24 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.522 ' CG2' HD13 ' B' ' 3' ' ' LEU . 55.0 t -66.86 -25.87 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 121.334 -0.854 . . . . 0.0 108.758 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.52 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -68.51 -27.27 65.97 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.429 -0.795 . . . . 0.0 109.065 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.561 ' O ' ' N ' ' A' ' 83' ' ' ALA . 11.6 mtm -84.2 -70.09 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 108.971 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.534 HG11 ' CB ' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -45.65 -23.02 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 O-C-N 120.302 -1.498 . . . . 0.0 109.892 -179.658 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.551 ' CG2' ' N ' ' A' ' 82' ' ' THR . 4.0 t -85.25 -52.26 6.03 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.747 -1.221 . . . . 0.0 109.327 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.589 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.1 t -90.82 -51.31 5.43 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.705 -1.221 . . . . 0.0 107.705 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.589 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -37.02 -42.06 0.39 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.369 0.604 . . . . 0.0 109.628 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.42 -37.02 23.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.289 -0.882 . . . . 0.0 109.428 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.422 ' N ' ' O ' ' A' ' 82' ' ' THR . 2.8 t-160 -60.19 -16.15 30.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -85.89 -38.36 18.14 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.219 -0.926 . . . . 0.0 109.43 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 0.0 109.451 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.51 ' HG3' ' CG2' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -45.52 -71.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.255 -0.903 . . . . 0.0 109.622 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.579 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 4.0 mm? -57.6 -20.22 31.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.278 -0.889 . . . . 0.0 109.816 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.462 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -62.58 -62.38 1.78 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.196 -0.94 . . . . 0.0 109.521 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.526 ' O ' ' CB ' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -59.39 -40.38 86.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.272 -0.892 . . . . 0.0 109.661 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.519 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -68.45 -20.23 64.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.196 -0.94 . . . . 0.0 109.566 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.519 ' O ' ' CG1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -74.98 -59.37 2.77 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.548 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.465 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 3.4 t -76.52 -11.39 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 109.473 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' B' ' 5' ' ' LYS . . . -81.85 -68.41 0.7 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.265 -0.897 . . . . 0.0 109.533 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.58 ' O ' ' CE2' ' B' ' 73' ' ' PHE . 3.5 mm? -62.23 -30.09 70.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.431 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.519 ' CG1' ' O ' ' B' ' 7' ' ' MET . 74.2 mt -69.85 -47.55 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.903 -1.123 . . . . 0.0 108.785 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' B' ' 8' ' ' VAL . 0.5 OUTLIER -53.62 -37.86 63.47 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.622 ' HB ' ' CE2' ' B' ' 17' ' ' TYR . 0.8 OUTLIER -72.99 -40.41 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 O-C-N 121.136 -0.978 . . . . 0.0 109.495 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 5.9 t80 -45.61 -47.21 14.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.836 -1.165 . . . . 0.0 108.224 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -80.3 -26.93 38.62 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.436 -0.79 . . . . 0.0 109.551 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -68.06 -70.15 0.28 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.995 . . . . 0.0 108.915 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.627 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 40.3 m-85 -49.71 -48.79 49.66 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.333 -0.854 . . . . 0.0 109.319 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 81.2 p -56.33 -35.35 67.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 109.716 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.465 ' HA2' ' HG2' ' B' ' 24' ' ' LYS . . . -66.58 -36.25 91.12 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 2.5 mmt180 -44.01 -28.29 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.276 -1.131 . . . . 0.0 109.513 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.456 ' HB3' ' HE3' ' B' ' 28' ' ' LYS . 5.9 mm-40 -126.64 156.11 41.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.452 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.43 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . -44.03 161.49 0.07 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.418 ' HB2' ' NZ ' ' B' ' 26' ' ' LYS . 25.6 m-20 55.18 100.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.266 -1.138 . . . . 0.0 109.447 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.465 ' HG2' ' HA2' ' B' ' 19' ' ' GLY . 15.0 mtmt -99.34 64.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.472 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.563 ' CD2' ' O ' ' B' ' 25' ' ' HIS . 16.1 t60 -139.86 8.32 2.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.221 -0.925 . . . . 0.0 109.647 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.11 170.19 7.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.173 -0.955 . . . . 0.0 109.591 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.532 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 15.5 mt -107.63 148.84 28.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 1.9 ptpt -124.74 85.47 2.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.692 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' B' ' 30' ' ' SER . 24.5 ttmt 59.66 -86.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.371 -0.831 . . . . 0.0 110.231 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.502 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 10.1 m -42.97 -56.37 3.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 0.0 110.184 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.532 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 1.3 mp0 -47.49 -42.15 22.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.057 -1.027 . . . . 0.0 109.538 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.53 ' CD2' ' HB2' ' B' ' 27' ' ' LEU . 26.6 mt -55.39 -61.79 2.11 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.598 -0.689 . . . . 0.0 109.476 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.438 ' HE2' HG12 ' B' ' 53' ' ' VAL . 6.0 ttmt -47.89 -70.19 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.272 -0.893 . . . . 0.0 109.705 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.459 ' OE2' ' HA ' ' B' ' 31' ' ' GLU . 18.8 pt-20 -44.07 -28.76 0.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.16 -0.962 . . . . 0.0 109.463 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.627 ' CD2' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -58.75 -57.74 11.66 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.848 . . . . 0.0 109.479 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.643 ' CD1' ' CZ ' ' B' ' 76' ' ' PHE . 2.6 mp -74.07 -55.11 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.687 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.422 ' C ' ' O ' ' B' ' 36' ' ' ILE . 4.9 m120 -41.75 -27.6 0.12 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.308 -0.87 . . . . 0.0 109.771 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.524 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 3.1 m-20 -90.79 -45.65 8.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.189 -0.944 . . . . 0.0 109.549 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CG1' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -73.25 -65.65 0.78 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.165 -0.959 . . . . 0.0 109.511 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' B' ' 40' ' ' LEU . 8.5 mp -62.88 -49.71 73.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.257 -0.902 . . . . 0.0 109.48 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.203 -0.936 . . . . 0.0 109.376 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.528 ' CD1' HG22 ' B' ' 53' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' B' ' 49' ' ' GLU . 2.8 ptpt -43.41 -26.89 0.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.853 . . . . 0.0 109.528 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.514 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.1 tt0 178.36 -32.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.449 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.526 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 1.2 mt-30 165.09 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.287 -0.883 . . . . 0.0 109.451 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -70.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.18 -0.95 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.537 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 2.4 t -90.18 -24.37 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.206 -0.934 . . . . 0.0 109.238 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.528 HG22 ' CD1' ' B' ' 47' ' ' ILE . 40.0 t -75.97 -29.86 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.219 -0.926 . . . . 0.0 108.885 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.526 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 6.8 t0 -79.82 -39.67 30.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.326 -0.859 . . . . 0.0 108.895 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.476 ' O ' HG22 ' B' ' 59' ' ' THR . 44.3 mmtt -65.54 -51.93 56.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 109.029 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.573 ' HA ' HG22 ' B' ' 59' ' ' THR . 16.5 m -55.8 -45.93 79.73 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 O-C-N 121.287 -0.883 . . . . 0.0 109.641 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.494 ' HE1' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.01 -31.66 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.809 -1.182 . . . . 0.0 110.224 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.465 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.1 OUTLIER -90.63 -35.98 14.66 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.142 -0.974 . . . . 0.0 109.361 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.573 HG22 ' HA ' ' B' ' 56' ' ' VAL . 0.8 OUTLIER -73.15 -60.33 2.29 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.387 -0.82 . . . . 0.0 110.031 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.627 ' CD1' ' CG ' ' B' ' 76' ' ' PHE . 2.9 mt -45.33 -44.21 11.45 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.923 . . . . 0.0 109.61 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 57' ' ' MET . 19.9 p-10 -89.95 111.53 22.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 109.494 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -98.34 -23.13 15.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.569 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -82.26 -20.01 38.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.552 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.26 94.21 0.61 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 173.11 -30.62 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.259 -1.142 . . . . 0.0 108.599 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.29 21.14 7.08 Favored Glycine 0 N--CA 1.485 1.926 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -107.74 99.72 9.17 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.246 -1.149 . . . . 0.0 109.409 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 17.2 t -72.43 157.4 37.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.191 -0.943 . . . . 0.0 109.698 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.475 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 1.1 m-20 -117.17 171.58 7.85 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.498 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.1 OUTLIER -59.05 -50.2 74.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.305 -179.715 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.463 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 18.4 mt-30 -55.81 -45.53 78.28 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.27 -0.894 . . . . 0.0 108.944 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -76.82 -13.29 60.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.408 -0.807 . . . . 0.0 109.395 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.58 ' CE2' ' O ' ' B' ' 10' ' ' LEU . 6.5 t80 -70.72 -66.88 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.191 -0.943 . . . . 0.0 108.607 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.52 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 4.1 mtt -58.59 -39.03 79.24 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.341 -0.849 . . . . 0.0 108.884 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.522 ' HB1' ' CB ' ' A' ' 75' ' ' ALA . . . -64.64 -29.8 70.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.294 -0.879 . . . . 0.0 109.059 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.643 ' CZ ' ' CD1' ' B' ' 36' ' ' ILE . 2.0 t80 -64.45 -63.7 1.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.422 -0.798 . . . . 0.0 109.287 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.525 ' CG1' ' OE2' ' B' ' 39' ' ' GLU . 49.5 t -56.9 -25.71 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.334 -0.854 . . . . 0.0 109.111 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.533 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -66.11 -41.81 90.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.325 -0.859 . . . . 0.0 109.415 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 3.0 mtm -73.79 -67.1 0.63 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.261 -0.899 . . . . 0.0 109.41 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.563 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -44.46 -25.04 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 120.637 -1.289 . . . . 0.0 109.247 -179.576 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.465 ' OG1' HD12 ' B' ' 40' ' ' LEU . 13.0 m -76.3 -70.05 0.47 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.154 -0.966 . . . . 0.0 108.963 178.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.6 t -77.13 -49.53 15.03 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.171 -0.956 . . . . 0.0 108.922 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.571 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.71 -31.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.757 -0.589 . . . . 0.0 109.774 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.477 ' N ' ' O ' ' B' ' 82' ' ' THR . 47.6 t -87.47 -42.25 12.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.317 -0.864 . . . . 0.0 109.535 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.2 OUTLIER -65.69 -9.96 32.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 109.536 -179.941 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -17.65 64.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.191 -0.943 . . . . 0.0 109.506 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 65.1 t80 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.517 ' HB3' ' CB ' ' A' ' 4' ' ' GLU . 1.3 m . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.521 ' OE1' ' CB ' ' B' ' 12' ' ' ASP . 0.5 OUTLIER -73.9 -38.89 64.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.578 ' CD1' ' CD2' ' B' ' 10' ' ' LEU . 2.9 mm? -80.33 -34.39 36.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.26 -0.9 . . . . 0.0 109.43 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.517 ' CB ' ' HB3' ' A' ' 1' ' ' SER . 25.9 tt0 -60.13 -58.34 8.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -63.11 -38.78 92.53 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.22 -0.925 . . . . 0.0 109.254 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.527 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -73.22 -11.87 60.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.254 -0.904 . . . . 0.0 109.399 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -42.84 16.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.437 ' O ' HG21 ' A' ' 11' ' ' ILE . 22.0 t -75.53 -25.87 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.405 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.98 -50.01 9.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.224 -0.923 . . . . 0.0 109.514 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.57 HD11 ' CZ ' ' A' ' 73' ' ' PHE . 3.9 mm? -62.52 -33.23 74.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.535 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -73.25 -46.33 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.926 . . . . 0.0 109.468 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.535 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 9.5 t70 -65.83 -16.94 64.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.292 -0.88 . . . . 0.0 109.414 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.576 HG13 ' CZ ' ' A' ' 73' ' ' PHE . 2.8 t -89.99 -37.3 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 0.0 109.359 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 68.7 t80 -62.83 -43.73 98.02 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.02 -1.05 . . . . 0.0 109.456 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 47.8 m170 -82.19 -49.93 9.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.303 -0.873 . . . . 0.0 109.795 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.2 tt0 -52.1 -59.75 4.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 109.612 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.625 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 44.7 m-85 -60.57 -48.71 80.59 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.897 . . . . 0.0 109.675 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB3' HD22 ' A' ' 27' ' ' LEU . 60.1 p -63.04 -11.61 20.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.208 -0.932 . . . . 0.0 109.689 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.515 ' HA2' ' CA ' ' A' ' 24' ' ' LYS . . . -70.69 -37.57 67.23 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 9.9 mmt180 -44.13 -41.63 5.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 8.5 tt0 -76.46 82.91 3.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 0.0 109.447 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.13 -91.15 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 21' ' ' GLU . 12.6 p30 -96.59 158.14 15.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' CA ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -89.63 119.91 30.46 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.31 -0.869 . . . . 0.0 109.449 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -169.58 -49.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -0.947 . . . . 0.0 109.693 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.503 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 3.6 mtmt -136.48 170.12 16.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 109.71 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.533 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 24.2 mt -102.43 150.36 23.44 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.292 -0.88 . . . . 0.0 109.463 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.523 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -115.56 70.05 0.74 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.171 -0.956 . . . . 0.0 109.854 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 63.34 -82.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.552 -0.717 . . . . 0.0 110.792 179.215 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.46 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 t -48.99 -29.09 4.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.034 -1.041 . . . . 0.0 110.32 -179.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.533 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 2.8 mp0 -66.84 -41.89 86.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.95 -1.094 . . . . 0.0 108.794 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.526 ' CD1' ' HE3' ' A' ' 57' ' ' MET . 14.8 mt -59.71 -61.22 2.78 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.526 ' CD ' HG13 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.49 -45.06 2.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.645 -0.66 . . . . 0.0 109.437 179.627 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.414 ' OE1' ' CA ' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -53.09 -61.32 2.38 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 109.319 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.625 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 3.2 mm? -54.81 -25.6 29.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.266 -0.896 . . . . 0.0 109.929 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.585 HD13 ' CE2' ' A' ' 76' ' ' PHE . 26.6 mm -64.09 -44.79 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.049 -1.032 . . . . 0.0 109.906 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.505 ' ND2' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -82.42 -52.73 6.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.114 -0.991 . . . . 0.0 109.931 -179.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.425 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.8 OUTLIER -40.52 -52.27 2.83 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.39 -0.818 . . . . 0.0 110.248 -179.584 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.535 ' HB3' ' CB ' ' B' ' 3' ' ' LEU . 0.1 OUTLIER -96.28 -26.12 15.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.058 -1.026 . . . . 0.0 109.949 -179.506 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.512 ' CD2' ' SD ' ' B' ' 7' ' ' MET . 5.7 mt -135.51 67.46 1.48 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.462 ' HB2' ' CA ' ' A' ' 37' ' ' ASN . 11.4 t . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.863 . . . . 0.0 109.455 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.535 ' CG2' HG22 ' A' ' 53' ' ' VAL . 6.7 mt . . . . . 0 N--CA 1.495 1.782 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 0.6 OUTLIER 83.49 -43.5 0.1 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.509 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.5 mt-10 168.95 36.61 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.135 -0.978 . . . . 0.0 109.311 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 57.85 36.15 26.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 109.34 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -90.15 -37.38 14.23 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.262 -0.899 . . . . 0.0 109.756 -179.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.535 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 2.9 t -98.06 -28.42 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.108 -0.995 . . . . 0.0 109.83 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.574 ' CG2' ' CG2' ' A' ' 36' ' ' ILE . 25.3 t -73.15 -37.35 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.03 -1.044 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -22.32 21.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.143 -0.973 . . . . 0.0 109.281 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 23.8 tttt -84.1 -25.02 30.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.251 -0.906 . . . . 0.0 109.369 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.535 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 2.2 m -59.54 -48.26 87.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 O-C-N 121.235 -0.916 . . . . 0.0 109.852 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.526 ' HE3' ' CD1' ' A' ' 32' ' ' LEU . 15.0 tpp -45.34 -24.62 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.738 -1.226 . . . . 0.0 109.596 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 56' ' ' VAL . 5.7 mm-40 -88.81 -42.14 12.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 109.304 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.1 m -72.44 -62.39 1.46 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.926 . . . . 0.0 109.307 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.523 ' CD1' ' HB2' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -85.23 44.04 1.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 109.493 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 57' ' ' MET . 15.8 p-10 -77.9 109.98 12.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 109.337 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.523 ' CB ' ' O ' ' A' ' 67' ' ' GLU . 36.8 t30 -49.46 -52.38 29.48 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.163 -0.961 . . . . 0.0 109.44 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -165.49 22.97 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.0 109.997 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.44 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 69.78 94.61 0.06 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.44 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.2 OUTLIER 170.13 -29.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.327 -1.102 . . . . 0.0 108.366 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.46 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 110.21 17.11 9.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 62' ' ' ASN . 2.7 pt-20 -113.09 91.2 3.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.27 -1.135 . . . . 0.0 109.109 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.527 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.44 130.89 43.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.681 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' OD1' ' ND2' ' A' ' 62' ' ' ASN . 2.5 m-20 -101.56 170.55 8.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.409 -0.807 . . . . 0.0 108.876 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.411 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.95 -48.69 64.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.033 -1.042 . . . . 0.0 110.457 -179.702 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.51 ' O ' ' CE ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.28 -41.09 65.21 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 109.416 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.527 ' HG2' ' CA ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -74.53 -23.1 58.76 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 120.929 -1.107 . . . . 0.0 109.062 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.576 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 18.3 t80 -64.07 -52.73 57.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.197 -0.939 . . . . 0.0 108.534 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.547 ' HB3' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.37 -37.85 82.03 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.19 -0.944 . . . . 0.0 108.995 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.529 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -72.73 -19.19 61.43 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.98 . . . . 0.0 108.939 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.585 ' CE2' HD13 ' A' ' 36' ' ' ILE . 9.8 t80 -71.84 -68.31 0.47 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.493 -0.754 . . . . 0.0 109.27 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.584 ' N ' ' CD1' ' A' ' 76' ' ' PHE . 39.3 t -66.42 -31.15 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.295 -0.878 . . . . 0.0 109.452 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -59.63 -40.66 88.36 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.282 -0.886 . . . . 0.0 109.384 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.569 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 2.1 mmt -77.76 -71.18 0.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.187 -0.945 . . . . 0.0 109.693 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.544 ' CG2' ' O ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -44.04 -24.39 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.296 -1.502 . . . . 0.0 109.736 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.509 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 13.1 m -77.09 -68.81 0.57 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 108.665 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.34 -49.74 11.11 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.577 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.19 -40.03 0.47 Allowed 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.334 0.588 . . . . 0.0 109.589 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.04 -32.88 16.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.263 -0.898 . . . . 0.0 109.477 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -66.34 -9.95 38.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.889 . . . . 0.0 109.534 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.38 -43.43 40.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.483 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.515 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.289 0.566 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -58.03 -75.74 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 109.66 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.535 ' CB ' ' HB3' ' A' ' 39' ' ' GLU . 5.9 mp -76.82 -29.68 56.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.606 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.515 ' HB3' ' CB ' ' B' ' 1' ' ' SER . 41.8 tt0 -58.03 -57.69 11.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.139 -0.976 . . . . 0.0 109.146 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.1 OUTLIER -61.27 -47.04 87.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.323 -0.861 . . . . 0.0 109.166 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -65.36 -12.68 54.42 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.288 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.512 ' SD ' ' CD2' ' A' ' 40' ' ' LEU . 8.6 ttt -80.81 -44.45 18.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.362 -0.836 . . . . 0.0 109.296 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.38 -44.81 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.898 . . . . 0.0 109.315 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.428 ' C ' ' HB3' ' A' ' 2' ' ' GLU . . . -67.84 -55.85 11.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.291 -0.88 . . . . 0.0 109.306 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.578 ' CD2' ' CD1' ' A' ' 3' ' ' LEU . 20.9 mt -45.37 -49.8 12.75 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.249 -0.907 . . . . 0.0 109.237 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.463 ' CD1' ' O ' ' B' ' 7' ' ' MET . 9.3 mt -60.17 -38.64 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.302 -0.874 . . . . 0.0 109.365 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -57.58 -28.64 63.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.608 ' CG1' ' CE1' ' B' ' 73' ' ' PHE . 2.1 t -82.92 -30.82 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.208 -0.933 . . . . 0.0 109.268 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.486 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 22.1 t80 -60.79 -51.1 70.75 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.84 -1.162 . . . . 0.0 109.211 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.447 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -80.16 -37.64 33.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.892 . . . . 0.0 109.615 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.2 tt0 -55.67 -65.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.211 -0.931 . . . . 0.0 109.487 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.572 ' CD2' ' HG ' ' B' ' 35' ' ' LEU . 28.8 m-85 -59.48 -49.73 76.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.552 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.509 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 53.2 p -57.95 -17.27 15.98 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.583 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.94 -37.22 16.53 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CZ ' ' OE1' ' B' ' 34' ' ' GLU . 56.4 mtp85 -46.22 -44.16 15.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -1.137 . . . . 0.0 109.465 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.58 169.97 17.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.432 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -48.37 -54.37 13.16 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' O ' ' O ' ' B' ' 18' ' ' SER . 73.2 m-20 -70.15 170.96 10.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -1.118 . . . . 0.0 109.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' B' ' 18' ' ' SER . 1.0 OUTLIER -141.22 70.52 1.35 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.863 . . . . 0.0 109.466 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.486 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -170.01 -36.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.362 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.515 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -121.89 170.19 10.04 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.919 . . . . 0.0 109.382 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.533 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 3.6 mp -102.21 144.92 30.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.952 . . . . 0.0 109.705 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -97.73 82.11 3.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.52 ' HG2' ' CG ' ' B' ' 57' ' ' MET . 0.0 OUTLIER 41.42 -83.87 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.591 -0.693 . . . . 0.0 110.955 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.604 ' N ' ' O ' ' B' ' 28' ' ' LYS . 4.7 t -48.5 -27.38 2.67 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.788 -1.195 . . . . 0.0 109.959 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.54 ' O ' ' CG ' ' B' ' 34' ' ' GLU . 2.8 mp0 -59.48 -47.01 87.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.894 -1.129 . . . . 0.0 108.38 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.522 ' N ' HD21 ' B' ' 27' ' ' LEU . 4.1 mt -59.11 -42.99 91.85 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.526 ' CG ' HG12 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -45.64 -67.73 0.26 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.517 -0.739 . . . . 0.0 109.722 179.715 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.54 ' CG ' ' O ' ' B' ' 31' ' ' GLU . 12.7 pt-20 -45.49 -44.28 12.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.151 -0.968 . . . . 0.0 109.786 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.572 ' HG ' ' CD2' ' B' ' 17' ' ' TYR . 3.2 mt -52.28 -45.73 65.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.1 -1.0 . . . . 0.0 109.617 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.579 HG13 ' CE1' ' B' ' 76' ' ' PHE . 11.9 mt -73.14 -23.84 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.258 -0.901 . . . . 0.0 109.853 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.541 ' ND2' ' N ' ' B' ' 37' ' ' ASN . 0.4 OUTLIER -95.18 -1.06 52.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.165 -0.959 . . . . 0.0 109.679 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -109.89 -20.06 12.89 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.159 -0.963 . . . . 0.0 109.285 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.535 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 10.9 mm-40 -121.44 -22.14 6.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.316 -0.865 . . . . 0.0 109.612 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.532 ' CD1' ' HB ' ' B' ' 80' ' ' VAL . 4.5 mt -110.5 59.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.219 -0.926 . . . . 0.0 109.535 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.29 -0.881 . . . . 0.0 109.555 179.903 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.524 ' CD1' HG22 ' B' ' 53' ' ' VAL . 2.3 mm . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER -43.34 -38.92 2.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.5 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -163.92 70.15 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.267 -0.896 . . . . 0.0 109.211 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.535 ' CG ' ' O ' ' B' ' 49' ' ' GLU . 16.5 pt20 41.91 37.48 0.81 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.435 -0.791 . . . . 0.0 109.546 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -65.23 -70.3 0.24 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 109.584 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 2.1 t -86.04 -13.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.125 -0.985 . . . . 0.0 109.439 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.526 HG12 ' CG ' ' B' ' 33' ' ' LYS . 69.0 t -81.03 -29.36 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.0 109.014 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.461 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 33.6 t70 -87.5 -26.1 23.36 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.203 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.2 -40.43 18.13 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 0.0 109.454 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.538 ' CG2' ' O ' ' B' ' 52' ' ' VAL . 21.0 m -59.83 -45.69 94.56 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 O-C-N 121.205 -0.934 . . . . 0.0 109.606 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.52 ' CG ' ' HG2' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -43.06 -27.36 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.969 -1.082 . . . . 0.0 109.258 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' B' ' 56' ' ' VAL . 4.1 mt-10 -83.25 -43.33 16.18 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.302 -0.874 . . . . 0.0 108.793 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.514 ' CG2' ' SD ' ' B' ' 79' ' ' MET . 38.1 m -75.46 -65.82 0.85 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.524 ' CD1' ' HB ' ' B' ' 56' ' ' VAL . 5.9 mt -41.03 -55.61 2.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.467 -0.771 . . . . 0.0 109.221 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.05 109.56 20.6 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.263 -0.898 . . . . 0.0 109.521 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.74 3.33 17.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' B' ' 64' ' ' GLY . 3.8 p30 -98.28 -45.83 6.03 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.516 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 102.06 95.13 2.26 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 57.5 t0 177.5 -32.86 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -1.134 . . . . 0.0 108.583 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.25 -21.62 24.1 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.448 ' HB3' ' HE3' ' B' ' 26' ' ' LYS . 26.0 mt-10 -75.82 106.71 7.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -1.134 . . . . 0.0 109.406 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.526 ' CB ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -69.68 124.03 22.9 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.237 -0.914 . . . . 0.0 109.437 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -92.14 171.0 9.38 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.389 -0.82 . . . . 0.0 109.112 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.411 ' CE2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.43 -50.62 67.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.929 -1.107 . . . . 0.0 109.871 -179.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.461 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -49.21 -29.96 6.36 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.328 -0.857 . . . . 0.0 109.635 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.539 ' HG3' ' N ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -79.13 -34.05 43.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.124 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.608 ' CE1' ' CG1' ' B' ' 13' ' ' VAL . 26.8 t80 -61.2 -55.88 27.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.059 -1.026 . . . . 0.0 108.993 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.522 ' CB ' ' HB3' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -62.39 -39.06 92.01 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.385 -0.822 . . . . 0.0 108.818 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.518 ' CB ' ' SD ' ' A' ' 74' ' ' MET . . . -67.75 -18.9 65.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.333 -0.854 . . . . 0.0 108.819 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -71.72 -67.46 0.53 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.415 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.606 ' N ' ' CG ' ' B' ' 76' ' ' PHE . 41.4 t -56.94 -31.77 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.493 -0.754 . . . . 0.0 109.608 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.547 ' CB ' ' HB3' ' A' ' 74' ' ' MET . . . -66.55 -38.86 88.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.894 . . . . 0.0 110.147 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.566 ' O ' ' N ' ' B' ' 83' ' ' ALA . 9.4 mtp -78.35 -71.52 0.42 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.007 -1.058 . . . . 0.0 109.527 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.532 ' HB ' ' CD1' ' B' ' 40' ' ' LEU . 0.0 OUTLIER -43.36 -25.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.848 0 O-C-N 120.445 -1.409 . . . . 0.0 109.654 -179.562 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.481 ' N ' ' O ' ' B' ' 79' ' ' MET . 8.8 m -78.1 -68.79 0.6 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.963 -1.086 . . . . 0.0 108.612 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.6 t -79.32 -49.96 11.62 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.0 108.628 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.574 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -38.62 -41.2 0.67 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.334 0.588 . . . . 0.0 109.602 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 1.7 t -89.3 -33.48 16.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 0.0 109.551 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' B' ' 81' ' ' THR . 3.2 t-160 -61.28 -15.41 34.92 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.431 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.3 -40.84 64.2 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.242 -0.911 . . . . 0.0 109.469 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 t80 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.488 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.456 ' HB2' ' HB3' ' A' ' 4' ' ' GLU . 57.6 m . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.92 -71.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 109.824 -179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.524 ' CD1' ' HG ' ' B' ' 10' ' ' LEU . 3.2 mm? -73.23 -35.29 66.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.112 -0.992 . . . . 0.0 109.836 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.456 ' HB3' ' HB2' ' A' ' 1' ' ' SER . 19.6 tp10 -55.71 -63.16 1.26 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 109.505 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.51 -47.24 86.49 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 10' ' ' LEU . . . -64.49 -11.15 30.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.277 -0.889 . . . . 0.0 109.452 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.408 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 60.5 ttp -85.4 -41.24 15.61 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.465 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.457 ' O ' HG21 ' A' ' 11' ' ' ILE . 85.5 t -70.79 -29.79 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.521 ' CB ' ' HG3' ' B' ' 2' ' ' GLU . . . -78.93 -54.72 5.76 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.576 ' HG ' ' CZ ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -55.92 -46.16 78.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.532 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.532 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -59.2 -46.17 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.183 -0.948 . . . . 0.0 109.308 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.532 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 2.7 t0 -59.01 -22.94 61.47 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.174 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.573 HG12 ' CD1' ' A' ' 17' ' ' TYR . 2.3 t -82.79 -27.4 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.189 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.485 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 22.4 t80 -69.9 -46.64 64.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.973 -1.079 . . . . 0.0 109.45 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -34.79 49.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.649 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.87 -63.32 1.08 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.248 -0.907 . . . . 0.0 109.597 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.577 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 37.5 m-85 -59.14 -51.92 67.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.305 -0.872 . . . . 0.0 109.623 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.48 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 13.9 m -62.41 -12.7 23.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.215 -0.928 . . . . 0.0 109.505 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.461 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -82.83 10.67 56.43 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 -39.4 17.37 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -1.17 . . . . 0.0 109.465 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.517 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 2.6 tt0 -84.15 82.1 8.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 109.467 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.49 -132.93 12.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 1.7 m-20 -64.03 -91.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -1.142 . . . . 0.0 109.484 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER 176.54 132.33 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.419 ' C ' ' HG3' ' A' ' 26' ' ' LYS . 15.3 p-80 -170.03 -53.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.149 -0.969 . . . . 0.0 109.835 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CE ' ' HB3' ' A' ' 67' ' ' GLU . 50.4 mtmt -148.74 170.19 18.76 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.128 -0.982 . . . . 0.0 109.843 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.502 HD21 ' N ' ' A' ' 32' ' ' LEU . 5.2 mp -94.35 152.16 18.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.282 -0.887 . . . . 0.0 109.806 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -116.65 69.25 0.75 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.111 -0.993 . . . . 0.0 109.324 179.585 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.44 ' HG2' ' HG3' ' A' ' 57' ' ' MET . 0.0 OUTLIER 62.71 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.625 -0.672 . . . . 0.0 110.639 179.352 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.5 p -50.64 -29.94 12.28 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.7 -1.25 . . . . 0.0 109.799 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 9.6 mt-10 -66.2 -42.54 88.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.04 -1.038 . . . . 0.0 108.274 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.6 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -54.12 -60.74 2.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.083 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.528 ' CD ' HG23 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.71 -53.07 4.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.798 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.36 -51.2 11.51 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.238 -0.913 . . . . 0.0 109.705 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.577 ' HG ' ' CE2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -57.35 -55.61 32.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.329 -0.857 . . . . 0.0 109.925 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.636 ' CD1' ' CE1' ' A' ' 76' ' ' PHE . 68.0 mt -64.61 -9.36 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.188 -0.945 . . . . 0.0 109.966 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 9.2 m120 -91.31 -74.43 0.5 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.076 -1.015 . . . . 0.0 109.563 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -62.02 -12.44 18.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.689 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.495 ' CG ' ' O ' ' A' ' 35' ' ' LEU . 6.1 mm-40 -110.83 -44.47 3.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.162 -0.961 . . . . 0.0 109.698 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.469 ' HB2' ' HA ' ' A' ' 36' ' ' ILE . 1.9 mt -108.4 64.94 0.62 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.128 -0.983 . . . . 0.0 109.472 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.328 -0.857 . . . . 0.0 109.558 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.511 HG23 ' CA ' ' A' ' 50' ' ' GLN . 2.5 mm . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -67.65 0.23 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.285 -0.885 . . . . 0.0 109.253 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 1.9 tt0 -139.45 42.2 2.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 109.238 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.518 ' HA ' ' CG1' ' A' ' 53' ' ' VAL . 0.2 OUTLIER 68.62 56.5 0.45 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.311 -0.868 . . . . 0.0 109.34 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -88.64 -70.35 0.65 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -0.933 . . . . 0.0 109.543 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.545 ' CG1' ' CG1' ' A' ' 80' ' ' VAL . 5.4 t -88.0 -23.36 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.13 -0.981 . . . . 0.0 109.289 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.528 HG23 ' CD ' ' A' ' 33' ' ' LYS . 2.8 p -72.5 -32.05 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.012 -1.055 . . . . 0.0 108.731 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.479 ' N ' HG11 ' A' ' 53' ' ' VAL . 23.0 t0 -90.37 -37.21 14.15 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.465 -0.772 . . . . 0.0 109.139 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 1.1 ttmt -68.43 -31.82 71.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.335 -0.853 . . . . 0.0 109.427 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 3.7 m -57.99 -49.69 80.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 O-C-N 121.224 -0.923 . . . . 0.0 109.703 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.469 ' O ' ' HB3' ' A' ' 61' ' ' ASP . 3.0 mmt -43.45 -26.88 0.23 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.807 -1.183 . . . . 0.0 109.496 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -78.37 -45.83 21.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.293 -0.879 . . . . 0.0 108.967 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 15.5 m -86.63 -62.16 1.57 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 109.382 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.6 ' CD2' ' CD2' ' A' ' 32' ' ' LEU . 4.7 mp -40.1 -28.25 0.05 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.412 -0.805 . . . . 0.0 109.981 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.469 ' HB3' ' O ' ' A' ' 57' ' ' MET . 8.9 p-10 -48.75 113.21 0.73 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.113 -0.992 . . . . 0.0 109.405 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -78.96 -49.97 11.9 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.209 -0.932 . . . . 0.0 109.503 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.11 -13.79 7.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.225 -0.922 . . . . 0.0 109.822 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 100.26 102.94 2.51 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' HB3' ' OE1' ' A' ' 67' ' ' GLU . 0.4 OUTLIER 167.31 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -1.111 . . . . 0.0 108.519 -179.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.56 -20.23 25.33 Favored Glycine 0 N--CA 1.485 1.911 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB3' ' CE ' ' A' ' 26' ' ' LYS . 6.8 mt-10 -69.9 103.28 2.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -1.146 . . . . 0.0 109.133 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.523 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.94 124.11 23.21 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.263 -0.898 . . . . 0.0 109.754 -179.36 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 29.9 t0 -94.21 170.46 9.5 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.457 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -53.96 -51.62 63.29 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 110.214 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.486 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -51.48 -34.66 36.63 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.21 -0.931 . . . . 0.0 109.453 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.523 ' HG2' ' CA ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -79.13 -27.74 42.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.164 -0.96 . . . . 0.0 109.8 -179.73 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.576 ' CZ ' ' HG ' ' A' ' 10' ' ' LEU . 19.5 t80 -62.47 -49.74 74.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.001 -1.062 . . . . 0.0 108.571 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.544 ' O ' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -63.15 -41.67 99.31 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.037 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.494 ' HA ' ' SD ' ' B' ' 74' ' ' MET . . . -72.4 -12.07 60.96 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' A' ' 36' ' ' ILE . 6.7 t80 -71.58 -70.05 0.35 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.521 ' CG2' ' HG ' ' B' ' 3' ' ' LEU . 44.1 t -69.22 -25.46 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.143 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.56 ' CB ' ' CB ' ' B' ' 74' ' ' MET . . . -69.12 -34.49 75.13 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.472 -0.768 . . . . 0.0 109.527 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.568 ' O ' ' N ' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -79.12 -70.73 0.48 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.178 -0.951 . . . . 0.0 108.876 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.545 ' CG1' ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -44.46 -24.36 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 O-C-N 120.593 -1.317 . . . . 0.0 109.512 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.465 ' N ' ' O ' ' A' ' 79' ' ' MET . 8.2 m -78.56 -69.02 0.59 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 0.0 108.599 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.5 t -79.09 -50.1 11.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.944 . . . . 0.0 108.659 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.573 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.46 -40.41 0.56 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.329 0.585 . . . . 0.0 109.619 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.08 -31.97 16.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.516 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -64.64 -11.34 34.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 11.8 pt-20 -65.4 -13.71 59.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.231 -0.918 . . . . 0.0 109.466 179.986 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.486 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 14.9 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.521 ' HG3' ' CB ' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -53.54 -60.44 3.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.254 -0.903 . . . . 0.0 109.588 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.562 ' CD1' ' CD1' ' A' ' 10' ' ' LEU . 3.6 mm? -69.51 -18.36 63.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.22 -0.925 . . . . 0.0 109.54 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' B' ' 1' ' ' SER . 0.6 OUTLIER -64.44 -63.4 1.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.383 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.91 -42.69 94.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.325 -0.859 . . . . 0.0 109.41 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.457 ' HA ' ' HB1' ' A' ' 6' ' ' ALA . . . -64.51 -23.13 67.17 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.237 -0.914 . . . . 0.0 109.509 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.461 ' O ' HG12 ' B' ' 11' ' ' ILE . 2.6 ttp -81.97 -29.75 32.01 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.57 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 47.1 t -72.52 -35.81 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.62 -52.23 12.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 109.499 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.581 ' CD2' ' CE2' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -57.33 -45.96 83.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.207 -0.933 . . . . 0.0 109.485 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.461 HG12 ' O ' ' B' ' 7' ' ' MET . 15.1 mm -55.07 -49.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.97 -20.54 66.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.579 ' CG1' ' CZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -76.33 -39.06 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 0.0 109.38 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 25.0 t80 -67.87 -46.4 71.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.956 -1.09 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.454 ' O ' ' HB2' ' B' ' 18' ' ' SER . 4.8 m80 -64.92 -54.59 28.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 0.0 109.66 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -56.14 -65.09 0.66 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.206 -0.934 . . . . 0.0 109.501 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.608 ' CZ ' ' CD1' ' B' ' 35' ' ' LEU . 39.1 m-85 -53.1 -20.39 3.68 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.282 -0.886 . . . . 0.0 109.474 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.458 ' O ' ' O ' ' B' ' 23' ' ' ASP . 0.5 OUTLIER -71.88 -50.63 27.66 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.722 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' B' ' 23' ' ' ASP . . . -90.5 53.78 3.45 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.512 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 15.0 mmm180 -90.2 -46.91 8.13 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -1.167 . . . . 0.0 109.603 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -139.1 81.47 1.84 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.177 -0.952 . . . . 0.0 109.85 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 85.5 -93.0 1.8 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' B' ' 18' ' ' SER . 16.2 m-20 -42.18 150.34 0.13 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.372 -1.075 . . . . 0.0 109.736 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.483 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 1.9 tmmt? -144.12 58.56 1.35 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 33.8 t60 -170.23 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 109.479 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -122.54 169.98 10.46 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 109.38 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.526 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 28.8 mt -119.34 127.81 53.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.947 . . . . 0.0 110.325 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.509 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -74.53 153.37 39.1 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.375 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.509 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 16.4 ttmt -36.86 -31.33 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.425 -0.797 . . . . 0.0 109.728 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 28' ' ' LYS . 2.8 t -72.35 -52.36 16.48 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.335 -0.853 . . . . 0.0 109.314 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.526 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -49.0 -44.95 41.71 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.115 -0.991 . . . . 0.0 108.553 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.523 HD23 ' CB ' ' B' ' 68' ' ' CYS . 28.7 mt -51.87 -67.13 0.28 Allowed 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.53 ' CG ' HG13 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.01 -28.92 0.09 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.416 -0.803 . . . . 0.0 109.789 179.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -70.06 -60.07 2.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.176 -0.952 . . . . 0.0 109.411 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.608 ' CD1' ' CZ ' ' B' ' 17' ' ' TYR . 11.9 tp -45.36 -48.44 13.33 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 0.0 109.654 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.647 ' CD1' ' CE1' ' B' ' 76' ' ' PHE . 31.1 mt -66.49 -34.64 71.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.213 -0.929 . . . . 0.0 109.562 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -86.14 7.15 26.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -0.903 . . . . 0.0 109.597 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.512 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 4.4 m-80 -105.21 -46.85 4.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.687 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.515 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 40.6 mp0 -124.9 -10.43 7.19 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.795 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . 0.1 OUTLIER -102.47 -4.49 25.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 0.0 109.55 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.971 . . . . 0.0 109.483 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.556 HG22 ' CG2' ' B' ' 53' ' ' VAL . 35.0 mm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 36.19 44.68 0.29 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.671 -0.643 . . . . 0.0 109.846 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 1.6 pt-20 86.54 -172.47 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.528 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -85.07 63.92 8.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.012 -1.055 . . . . 0.0 109.539 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.64 -70.45 0.68 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.152 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.531 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 1.5 t -88.64 -25.0 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.102 -0.999 . . . . 0.0 109.623 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.556 ' CG2' HG22 ' B' ' 47' ' ' ILE . 2.5 t -72.46 -29.62 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 O-C-N 120.983 -1.073 . . . . 0.0 108.228 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.463 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.79 -42.13 10.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.0 109.123 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -33.56 76.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.349 -0.844 . . . . 0.0 109.589 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.53 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 2.9 m -52.55 -55.25 11.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.474 ' C ' ' O ' ' B' ' 56' ' ' VAL . 2.5 tpt -40.17 -34.28 0.3 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.072 -1.017 . . . . 0.0 109.692 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.23 -56.83 10.58 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.257 -0.902 . . . . 0.0 108.772 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.531 ' CG2' ' HE3' ' B' ' 79' ' ' MET . 4.9 m -76.53 -65.5 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.356 -0.84 . . . . 0.0 108.864 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.592 HD22 ' CG ' ' B' ' 76' ' ' PHE . 4.6 mp -32.44 -38.1 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.308 0.575 . . . . 0.0 110.258 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 59' ' ' THR . 37.9 t0 -84.92 71.43 10.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.907 . . . . 0.0 109.507 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -86.99 -10.42 53.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 109.429 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.51 -41.64 9.24 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.23 -0.919 . . . . 0.0 109.444 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.74 89.58 1.96 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 175.54 -31.97 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.313 -1.11 . . . . 0.0 108.662 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.09 -32.18 6.89 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.525 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 3.6 mm-40 -69.93 126.82 30.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.339 -1.094 . . . . 0.0 109.31 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.559 ' CA ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -78.47 130.57 36.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.087 -1.008 . . . . 0.0 109.561 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.499 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -105.26 170.39 7.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.269 -0.894 . . . . 0.0 109.286 179.708 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.419 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.9 OUTLIER -49.4 -55.98 11.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.99 -1.069 . . . . 0.0 110.511 -179.742 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' B' ' 74' ' ' MET . 2.3 mt-30 -50.82 -32.63 20.71 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.177 -0.952 . . . . 0.0 109.73 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.559 ' HG2' ' CA ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -75.78 -32.71 60.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.948 -1.095 . . . . 0.0 109.543 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.607 ' CE1' ' CD2' ' B' ' 35' ' ' LEU . 3.0 t80 -62.66 -53.58 52.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.174 -0.954 . . . . 0.0 108.91 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.56 ' CB ' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -55.28 -46.96 76.15 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.541 -0.725 . . . . 0.0 109.795 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.571 ' CB ' ' CE ' ' B' ' 79' ' ' MET . . . -75.16 -14.28 60.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.075 -1.016 . . . . 0.0 109.195 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.647 ' CE1' ' CD1' ' B' ' 36' ' ' ILE . 1.9 t80 -71.83 -70.24 0.34 Allowed 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.396 -0.815 . . . . 0.0 109.317 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.515 ' O ' ' OG1' ' B' ' 81' ' ' THR . 39.4 t -59.47 -46.14 93.1 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.589 -0.694 . . . . 0.0 109.609 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.531 ' HB1' ' CG ' ' A' ' 74' ' ' MET . . . -51.99 -41.41 62.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.439 -0.788 . . . . 0.0 110.551 -179.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.571 ' CE ' ' CB ' ' B' ' 75' ' ' ALA . 12.6 mtm -69.83 -69.68 0.33 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.76 -1.213 . . . . 0.0 109.059 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.531 ' CG1' ' HB ' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -42.49 -23.96 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 120.867 -1.146 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.515 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 0.6 OUTLIER -77.54 -68.77 0.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.832 -1.168 . . . . 0.0 108.899 178.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -78.18 -49.95 12.86 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.138 -0.976 . . . . 0.0 108.367 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.581 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.77 -43.25 0.42 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.235 0.54 . . . . 0.0 109.846 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.45 ' SG ' ' HE3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -90.17 -31.94 16.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.532 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.46 ' HB2' ' HA ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -50.99 -34.59 29.68 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.285 -0.885 . . . . 0.0 109.584 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -46.67 -45.89 19.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.241 -0.912 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.415 ' HG3' ' C ' ' B' ' 9' ' ' ALA . 1.5 tp10 -64.58 -77.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.544 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.489 HD23 ' CD2' ' B' ' 35' ' ' LEU . 7.2 mp -71.5 -30.17 65.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -56.32 -57.64 11.41 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.0 109.459 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -62.03 -40.15 94.74 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.464 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.489 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -66.45 -17.06 64.58 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.464 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.524 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 36.3 ttp -84.46 -36.19 22.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.891 . . . . 0.0 109.514 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 t -68.03 -42.0 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.948 . . . . 0.0 109.522 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.444 ' CB ' ' HA ' ' B' ' 2' ' ' GLU . . . -77.32 -59.78 2.64 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.525 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 85.4 mt -47.77 -48.71 30.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.555 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.586 ' CD1' ' CZ ' ' A' ' 70' ' ' PHE . 23.6 mm -57.78 -48.14 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 3.1 t0 -62.98 -19.65 64.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.916 . . . . 0.0 109.554 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.624 ' CG1' ' CZ ' ' A' ' 73' ' ' PHE . 2.4 t -80.65 -29.72 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.301 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 18' ' ' SER . 15.1 t80 -73.73 -45.07 54.34 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.003 -1.061 . . . . 0.0 109.295 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.551 ' CE1' ' HD3' ' A' ' 24' ' ' LYS . 4.9 t60 -78.79 -29.36 44.93 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.301 -0.875 . . . . 0.0 109.617 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.6 tt0 -75.8 -62.25 1.65 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.494 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.49 ' CD1' HG11 ' A' ' 13' ' ' VAL . 27.9 m-85 -55.82 -48.09 76.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 14' ' ' PHE . 1.2 t -67.62 -20.04 65.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.923 . . . . 0.0 109.427 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.457 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -89.75 17.61 51.74 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -88.61 -57.53 2.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -1.166 . . . . 0.0 109.448 -179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -113.53 140.4 48.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.221 -0.924 . . . . 0.0 109.449 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.24 -119.11 4.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.491 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 4.2 m-20 -122.25 -80.67 0.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.224 -1.162 . . . . 0.0 109.463 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.565 ' O ' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER 165.51 99.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.499 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CD2' ' O ' ' A' ' 24' ' ' LYS . 55.1 m-70 -164.24 -41.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.519 ' CD ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -142.35 170.31 15.94 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.241 -0.912 . . . . 0.0 109.446 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 75.1 mt -112.01 134.26 53.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.92 . . . . 0.0 109.823 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 29' ' ' LYS . 3.6 mttt -81.79 165.16 21.14 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 28' ' ' LYS . 11.1 ptpt -45.0 -26.29 0.41 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.11 -0.994 . . . . 0.0 109.141 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 28' ' ' LYS . 4.9 p -82.43 -42.94 17.92 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.3 -0.875 . . . . 0.0 110.039 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.531 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 36.4 mm-40 -56.84 -42.91 80.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.972 -1.08 . . . . 0.0 108.666 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.561 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 29.8 mt -62.66 -62.74 1.53 Allowed 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.526 ' HG3' ' CG1' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.62 -28.44 0.07 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.415 -0.803 . . . . 0.0 109.677 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -70.97 -58.36 3.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.441 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.53 HD12 ' CG1' ' A' ' 13' ' ' VAL . 12.6 mt -51.88 -39.58 59.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.278 -0.888 . . . . 0.0 109.736 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.581 HG12 ' CZ ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -74.26 -29.17 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 1.8 m-80 -88.77 -3.14 58.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.93 . . . . 0.0 109.599 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -102.33 -45.91 4.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.188 -0.945 . . . . 0.0 109.512 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' B' ' 4' ' ' GLU . 0.6 OUTLIER -106.14 -18.32 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.511 ' CD2' ' HB ' ' A' ' 80' ' ' VAL . 0.4 OUTLIER -115.12 72.48 0.8 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.391 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 109.502 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.566 ' CD1' ' N ' ' A' ' 47' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 47' ' ' ILE . 8.9 pttt 173.81 -49.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.97 . . . . 0.0 109.24 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.425 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -131.5 21.19 4.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.371 -0.831 . . . . 0.0 109.062 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mp0 65.48 59.62 0.78 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 0.0 109.32 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.7 -70.36 0.67 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.254 -0.904 . . . . 0.0 109.522 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.539 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.5 t -86.2 -21.13 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.313 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.526 ' CG1' ' HG3' ' A' ' 33' ' ' LYS . 89.8 t -76.63 -28.37 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.036 . . . . 0.0 109.114 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.459 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 28.9 t0 -90.16 -34.88 15.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.289 -0.882 . . . . 0.0 109.448 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -40.81 62.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.216 -0.928 . . . . 0.0 109.692 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.55 ' HB ' ' CD1' ' A' ' 60' ' ' LEU . 34.9 m -62.65 -49.44 83.75 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.075 -1.015 . . . . 0.0 109.622 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.561 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 13.2 tpp -41.98 -25.94 0.08 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.725 -1.234 . . . . 0.0 109.49 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.4 tm-20 -79.72 -50.95 9.84 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.071 -1.018 . . . . 0.0 109.935 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.566 ' CG2' ' N ' ' A' ' 60' ' ' LEU . 2.3 t -77.7 -52.88 8.25 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.899 -1.126 . . . . 0.0 109.782 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.566 ' N ' ' CG2' ' A' ' 59' ' ' THR . 20.4 mt -40.54 -52.67 2.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -71.96 113.28 8.83 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.376 -0.828 . . . . 0.0 109.557 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -110.26 25.73 11.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.335 -0.853 . . . . 0.0 109.38 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.0 -37.01 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.262 -0.898 . . . . 0.0 109.461 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 91.42 73.97 1.27 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.7 OUTLIER -177.39 30.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -1.154 . . . . 0.0 108.471 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.51 63.83 3.82 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.519 ' HB2' ' CD ' ' A' ' 26' ' ' LYS . 3.6 pt-20 -162.96 110.85 1.26 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.326 -1.103 . . . . 0.0 109.298 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 1.8 m -69.59 167.58 16.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.508 ' O ' ' HB3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -127.4 172.11 10.94 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.586 ' CZ ' ' CD1' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.18 -62.13 2.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.648 -1.282 . . . . 0.0 110.352 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.552 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 5.0 pt20 -48.08 -27.08 2.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.151 -0.968 . . . . 0.0 108.845 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -74.82 -42.8 57.36 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.633 -0.667 . . . . 0.0 109.695 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.624 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 32.4 t80 -54.02 -46.85 71.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.317 -0.864 . . . . 0.0 109.611 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.529 ' CB ' ' CB ' ' B' ' 78' ' ' ALA . 1.6 tpp -63.8 -54.63 32.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 109.336 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.426 ' HB3' ' HB1' ' B' ' 75' ' ' ALA . . . -64.46 -10.62 26.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.241 -0.912 . . . . 0.0 109.534 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.581 ' CZ ' HG12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -74.39 -64.02 1.11 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.664 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.524 ' CG1' ' HE3' ' B' ' 74' ' ' MET . 87.0 t -58.2 -23.8 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.532 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -66.67 -40.76 88.75 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.525 -0.734 . . . . 0.0 109.19 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.575 ' O ' ' N ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -77.75 -70.95 0.44 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.271 -0.893 . . . . 0.0 109.512 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.574 HG22 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -44.05 -24.67 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 120.502 -1.374 . . . . 0.0 110.035 -179.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.487 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.2 m -79.64 -66.73 0.84 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.919 -1.113 . . . . 0.0 108.433 178.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.547 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.9 m -78.4 -53.9 6.76 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.575 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -36.88 -44.32 0.49 Allowed 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.259 0.552 . . . . 0.0 109.782 179.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.02 -47.43 65.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.564 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.27 -12.06 26.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.288 -0.883 . . . . 0.0 109.518 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.02 -31.86 17.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.454 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.47 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.444 ' HA ' ' CB ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.19 -70.74 0.11 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.0 109.791 -179.797 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.505 ' N ' ' CD1' ' B' ' 3' ' ' LEU . 7.8 mp -74.64 -37.81 62.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.077 -1.014 . . . . 0.0 109.809 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.502 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -52.7 -62.39 1.68 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.952 . . . . 0.0 109.547 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -60.94 -47.72 85.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.292 -0.88 . . . . 0.0 109.646 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -60.82 -13.8 17.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.239 -0.913 . . . . 0.0 109.627 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.406 ' O ' HD11 ' B' ' 11' ' ' ILE . 42.6 ttp -83.72 -49.34 9.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.51 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.479 HG11 ' N ' ' B' ' 9' ' ' ALA . 5.8 p -61.6 -34.28 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.285 -0.884 . . . . 0.0 109.648 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.479 ' N ' HG11 ' B' ' 8' ' ' VAL . . . -73.33 -60.25 2.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.538 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.574 HD11 ' CZ ' ' B' ' 73' ' ' PHE . 2.0 mm? -44.01 -49.54 8.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.42 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.406 HD11 ' O ' ' B' ' 7' ' ' MET . 13.6 mt -57.53 -47.97 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.233 -0.917 . . . . 0.0 109.548 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -51.34 -27.71 10.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.923 . . . . 0.0 109.474 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.543 HG12 ' CD1' ' B' ' 17' ' ' TYR . 2.1 t -84.79 -33.18 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.511 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 5.2 t80 -61.2 -49.11 78.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.882 -1.136 . . . . 0.0 109.471 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -78.06 -37.57 46.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.281 -0.887 . . . . 0.0 109.738 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 1.4 tp60 -60.07 -67.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.556 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.554 ' CE2' ' HG3' ' B' ' 34' ' ' GLU . 53.0 m-85 -57.99 -54.11 50.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 6.4 m -62.82 -12.7 26.28 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.0 109.589 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.88 -21.33 26.12 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.413 ' HB3' ' OE2' ' B' ' 21' ' ' GLU . 5.0 mmt180 -54.95 -47.04 75.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -1.117 . . . . 0.0 109.501 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.413 ' OE2' ' HB3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -168.83 147.98 4.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.491 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.77 -111.24 2.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.448 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -107.98 -78.76 0.58 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.204 -1.174 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER 168.56 -35.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 26.8 m80 -115.95 18.13 15.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.913 . . . . 0.0 109.429 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.468 ' HD2' ' HB2' ' B' ' 67' ' ' GLU . 30.5 mtmt -144.5 152.99 41.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.538 ' CG ' ' HB3' ' B' ' 31' ' ' GLU . 3.5 mp -93.59 142.77 26.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.129 -0.982 . . . . 0.0 109.739 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.589 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -98.78 86.29 3.49 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.365 -0.835 . . . . 0.0 109.099 179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 43.39 -86.18 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.43 -0.794 . . . . 0.0 110.826 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.589 ' N ' ' O ' ' B' ' 28' ' ' LYS . 39.1 t -47.82 -33.12 6.87 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.298 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.538 ' HB3' ' CG ' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -56.25 -44.25 79.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.795 -1.19 . . . . 0.0 109.216 -179.784 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.529 ' N ' HD21 ' B' ' 27' ' ' LEU . 5.2 mt -65.33 -52.82 51.32 Favored 'General case' 0 C--N 1.297 -1.712 0 O-C-N 121.479 -0.763 . . . . 0.0 109.124 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.509 ' HG2' ' CG1' ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.89 -64.27 0.61 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.39 -0.819 . . . . 0.0 109.884 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.554 ' HG3' ' CE2' ' B' ' 17' ' ' TYR . 5.0 pt-20 -47.34 -56.37 6.99 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.128 -0.983 . . . . 0.0 109.69 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.541 ' HG ' ' CD2' ' B' ' 17' ' ' TYR . 2.8 mt -43.51 -39.04 3.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.212 -0.93 . . . . 0.0 109.771 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.591 HG12 ' CZ ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -69.46 -52.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.252 -0.905 . . . . 0.0 109.529 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.442 ' OD1' HG13 ' B' ' 47' ' ' ILE . 40.5 m-80 -89.11 20.79 3.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 109.786 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 1.7 t30 -118.23 -36.12 3.65 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.973 . . . . 0.0 109.491 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 10.1 mm-40 -121.18 -14.27 8.39 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.23 -0.918 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' B' ' 36' ' ' ILE . 1.1 mt -113.25 52.97 0.77 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 -179.986 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.588 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 26.8 mm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.588 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 88.89 8.25 0.12 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.564 -0.71 . . . . 0.0 109.495 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.1 tt0 79.68 8.69 1.62 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.47 -0.769 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -176.19 21.25 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.73 -1.231 . . . . 0.0 111.475 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 51.5 tp10 -91.02 -70.74 0.67 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.488 -1.383 . . . . 0.0 109.331 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 1.2 t -93.56 -19.38 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.261 -0.899 . . . . 0.0 108.666 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.528 ' HA ' ' CG2' ' B' ' 56' ' ' VAL . 4.7 t -78.91 -20.44 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.369 -0.832 . . . . 0.0 109.233 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -85.1 -37.42 20.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.437 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -40.04 30.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 109.422 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.538 ' CG2' ' O ' ' B' ' 52' ' ' VAL . 34.1 m -63.9 -46.07 95.18 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 O-C-N 121.211 -0.931 . . . . 0.0 109.62 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.457 ' O ' ' HB2' ' B' ' 61' ' ' ASP . 4.9 tpt -41.87 -27.46 0.12 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.06 -1.025 . . . . 0.0 109.591 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.2 OUTLIER -84.5 -42.84 15.15 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.235 -0.916 . . . . 0.0 108.913 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.451 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.8 m -75.92 -63.99 1.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.353 -0.842 . . . . 0.0 109.753 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.534 ' CG ' ' HB ' ' B' ' 56' ' ' VAL . 3.8 mt -41.24 -39.43 1.35 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.461 ' OD2' ' HA2' ' B' ' 66' ' ' GLY . 50.2 m-20 -90.22 111.87 23.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.283 -0.885 . . . . 0.0 109.431 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' B' ' 72' ' ' GLU . 11.3 p-10 -95.99 -13.59 23.68 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.188 -0.945 . . . . 0.0 109.63 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.73 -22.01 13.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.612 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' B' ' 65' ' ' ASP . . . 80.68 99.82 0.33 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . 0.495 ' CB ' ' O ' ' B' ' 64' ' ' GLY . 0.5 OUTLIER 164.87 -26.16 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.25 -1.147 . . . . 0.0 108.608 -179.787 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.56 23.44 5.97 Favored Glycine 0 N--CA 1.484 1.874 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' B' ' 67' ' ' GLU . 3.3 pt-20 -110.49 86.27 2.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.366 -1.079 . . . . 0.0 109.316 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.462 ' O ' ' HG2' ' B' ' 26' ' ' LYS . 13.1 t -69.9 156.24 39.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.214 -0.929 . . . . 0.0 109.78 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.457 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.3 OUTLIER -118.71 171.42 8.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.438 -0.789 . . . . 0.0 108.996 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.45 -51.57 67.92 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.228 -0.92 . . . . 0.0 110.335 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.466 ' HG3' ' HG2' ' B' ' 72' ' ' GLU . 16.7 pt20 -57.39 -37.97 73.52 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.411 -0.805 . . . . 0.0 109.222 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.466 ' HG2' ' HG3' ' B' ' 71' ' ' GLN . 1.8 mt-10 -79.3 -15.72 57.51 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.445 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.574 ' CZ ' HD11 ' B' ' 10' ' ' LEU . 5.8 t80 -71.05 -63.41 1.11 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 108.708 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.532 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -60.56 -37.78 82.39 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.426 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . . . -59.58 -37.35 78.29 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.627 ' CE2' ' CG2' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -57.59 -67.39 0.34 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.627 ' CG2' ' CE2' ' B' ' 76' ' ' PHE . 49.4 t -52.9 -21.95 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.552 ' CB ' ' HA ' ' A' ' 71' ' ' GLN . . . -57.42 -58.0 10.18 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.482 -0.761 . . . . 0.0 108.953 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 27.0 mmm -70.82 -65.56 0.72 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.433 -0.792 . . . . 0.0 109.284 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.567 HG22 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -41.5 -25.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.655 -1.278 . . . . 0.0 110.12 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.514 ' CG2' HD13 ' A' ' 11' ' ' ILE . 5.3 m -75.75 -70.13 0.45 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.886 -1.134 . . . . 0.0 108.673 178.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -79.11 -49.53 12.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.0 108.327 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.568 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.94 -44.0 0.75 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.249 0.547 . . . . 0.0 109.789 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.22 -27.92 19.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.268 -0.895 . . . . 0.0 109.702 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.437 ' HB3' ' HA ' ' B' ' 82' ' ' THR . 81.4 t60 -70.81 -9.34 57.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 109.727 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -9.56 55.88 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.214 -0.929 . . . . 0.0 109.724 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.0 109.808 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.498 ' CG ' HG22 ' B' ' 13' ' ' VAL . 3.7 tt0 -62.03 -71.47 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -0.933 . . . . 0.0 109.493 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.526 ' HB3' ' CE ' ' A' ' 7' ' ' MET . 7.4 mp -71.98 -33.99 68.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.555 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.13 -61.7 2.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.219 -0.926 . . . . 0.0 109.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -61.56 -47.19 86.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 179.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.52 ' O ' ' CD1' ' A' ' 10' ' ' LEU . . . -59.79 -15.28 19.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.279 -0.888 . . . . 0.0 109.375 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.565 ' CE ' ' CD1' ' B' ' 40' ' ' LEU . 2.9 tpp -82.25 -63.77 1.31 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.213 -0.929 . . . . 0.0 109.539 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.414 ' C ' ' O ' ' A' ' 7' ' ' MET . 19.1 t -44.27 -44.92 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.145 -0.972 . . . . 0.0 109.633 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.461 ' HA ' ' OE2' ' B' ' 2' ' ' GLU . . . -67.15 -60.14 2.86 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' CZ ' ' A' ' 73' ' ' PHE . 3.5 mt -47.66 -70.26 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.212 -0.93 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.535 HG12 ' CZ ' ' A' ' 70' ' ' PHE . 40.5 mt -41.65 -36.95 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.418 -0.801 . . . . 0.0 110.025 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.517 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 2.8 m-20 -60.6 -48.88 79.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.159 -0.963 . . . . 0.0 110.044 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.526 ' CG1' HD12 ' A' ' 35' ' ' LEU . 1.1 t -62.85 -28.55 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.483 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.4 t80 -67.51 -41.97 83.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.9 -1.125 . . . . 0.0 109.601 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -73.43 -34.35 65.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.29 -0.881 . . . . 0.0 110.019 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.517 ' CG ' ' O ' ' A' ' 12' ' ' ASP . 2.1 mt-30 -69.4 -63.31 1.09 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.062 -1.024 . . . . 0.0 109.678 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.581 ' CZ ' ' CD1' ' A' ' 35' ' ' LEU . 11.5 m-85 -49.88 -44.42 49.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.377 -0.827 . . . . 0.0 109.908 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -65.2 -32.84 74.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.146 -0.971 . . . . 0.0 109.52 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.21 -13.97 30.74 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.524 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 10.0 mtp85 -81.65 -32.84 31.69 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 109.527 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -79.42 134.01 36.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.286 -0.884 . . . . 0.0 109.434 179.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.43 -24.91 1.81 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.452 ' HB2' ' OE1' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -72.11 -46.52 56.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.239 -1.153 . . . . 0.0 109.487 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 18' ' ' SER . 1.2 mttm 66.94 60.33 0.53 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.92 . . . . 0.0 109.43 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.453 ' HB3' ' HD3' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -170.23 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.217 -0.927 . . . . 0.0 109.759 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -142.65 169.93 16.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.158 -0.964 . . . . 0.0 109.783 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.52 ' CD2' ' HB3' ' A' ' 31' ' ' GLU . 22.0 mt -97.55 163.12 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.29 -0.881 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -126.97 69.95 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.128 -0.983 . . . . 0.0 109.936 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 16.5 tptm 63.85 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.468 -0.77 . . . . 0.0 110.695 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.6 p -46.23 -41.42 12.85 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.146 -0.971 . . . . 0.0 110.273 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -62.28 -39.96 94.68 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.971 -1.08 . . . . 0.0 108.845 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 70.0 mt -58.21 -71.05 0.12 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.777 -0.577 . . . . 0.0 109.459 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.532 ' HE3' ' CG2' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -43.89 -39.12 3.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.249 -0.907 . . . . 0.0 109.39 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -59.54 4.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.209 -0.932 . . . . 0.0 109.218 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD1' ' CZ ' ' A' ' 17' ' ' TYR . 13.4 tp -57.23 -55.54 33.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.418 -0.801 . . . . 0.0 109.404 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.494 HD13 ' CZ ' ' A' ' 76' ' ' PHE . 2.2 mt -43.65 -29.0 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.36 -0.838 . . . . 0.0 109.254 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 13.7 m120 -82.92 -40.63 19.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.251 -0.906 . . . . 0.0 109.812 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -95.31 21.22 8.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.187 -0.946 . . . . 0.0 109.777 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.537 ' OE1' ' CG2' ' A' ' 77' ' ' VAL . 22.8 pt-20 -129.52 -45.95 1.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.114 -0.992 . . . . 0.0 109.721 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.53 ' O ' ' CB ' ' A' ' 41' ' ' SER . 3.5 mp -76.67 -17.26 59.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.127 -0.983 . . . . 0.0 109.604 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.494 1.741 0 O-C-N 121.443 -0.786 . . . . 0.0 110.724 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.528 ' CG1' ' HD3' ' A' ' 33' ' ' LYS . 4.0 mt . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -44.69 -26.43 0.38 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.238 -0.914 . . . . 0.0 109.257 179.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER 172.96 49.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.314 -0.866 . . . . 0.0 109.271 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.513 ' N ' HG23 ' A' ' 47' ' ' ILE . 4.1 mp0 44.15 48.38 7.62 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.23 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -90.12 -53.55 4.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.912 -179.667 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.537 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 3.0 t -96.05 -20.21 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.129 -0.982 . . . . 0.0 110.041 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.532 ' CG2' ' HE3' ' A' ' 33' ' ' LYS . 37.1 t -81.5 -30.33 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.772 -1.205 . . . . 0.0 108.698 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.454 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -90.01 -24.4 21.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.405 -0.809 . . . . 0.0 108.848 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.8 OUTLIER -82.59 -48.42 11.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.38 -0.825 . . . . 0.0 109.208 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.567 HG23 ' CE1' ' A' ' 76' ' ' PHE . 33.0 m -57.6 -44.77 85.89 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 O-C-N 121.158 -0.964 . . . . 0.0 109.26 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.487 ' HE1' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -37.39 -30.87 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.483 -0.761 . . . . 0.0 109.632 -179.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.36 -44.99 12.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 56' ' ' VAL . 15.8 m -63.9 -65.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.651 ' CD1' ' CE2' ' A' ' 76' ' ' PHE . 3.3 mt -40.15 -66.76 0.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.444 -0.785 . . . . 0.0 109.602 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.435 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -45.76 94.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.45 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 60' ' ' LEU . 2.1 m-20 -109.62 -5.14 15.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.555 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -100.61 -39.79 7.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.206 -0.934 . . . . 0.0 109.383 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 68.92 0.83 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -168.76 25.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -1.153 . . . . 0.0 108.6 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.435 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 49.11 27.63 7.27 Favored Glycine 0 N--CA 1.482 1.705 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.458 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . 51.0 mm-40 -124.27 133.54 53.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.255 -1.144 . . . . 0.0 109.543 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 15.7 t -78.02 158.95 29.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.275 -0.891 . . . . 0.0 109.614 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.4 OUTLIER -127.21 171.63 11.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 108.877 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.592 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 0.1 OUTLIER -58.61 -54.02 51.77 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.293 -0.88 . . . . 0.0 110.488 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.46 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 1.2 pm0 -56.21 -29.71 61.31 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.093 -1.005 . . . . 0.0 108.887 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 6.8 mt-10 -80.13 -25.41 39.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 109.513 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.572 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 8.3 t80 -67.63 -55.65 12.46 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.307 -0.871 . . . . 0.0 108.83 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.515 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 8.9 mtt -61.34 -37.74 84.41 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.526 ' O ' ' CG ' ' A' ' 79' ' ' MET . . . -71.67 -19.9 62.02 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.47 -0.769 . . . . 0.0 109.018 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CE2' ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -72.96 -69.56 0.41 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.792 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.537 ' CG2' ' OE1' ' A' ' 39' ' ' GLU . 42.0 t -54.61 -38.81 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.241 -0.912 . . . . 0.0 109.647 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.569 ' CB ' ' HB3' ' B' ' 74' ' ' MET . . . -65.76 -29.53 70.05 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.309 -0.869 . . . . 0.0 109.924 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.544 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 18.9 mmm -82.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.045 -1.034 . . . . 0.0 109.57 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.529 ' CG1' ' HB ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.75 -20.81 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 O-C-N 120.399 -1.438 . . . . 0.0 109.709 -179.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.548 ' CG2' ' N ' ' A' ' 82' ' ' THR . 4.8 t -87.81 -50.93 6.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.795 -1.191 . . . . 0.0 109.371 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.586 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.2 t -90.32 -51.46 5.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.867 -1.145 . . . . 0.0 107.973 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.586 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -35.45 -37.04 0.08 Allowed 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.275 0.559 . . . . 0.0 109.946 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' A' ' 82' ' ' THR . 3.8 t -90.02 -38.04 13.88 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' A' ' 82' ' ' THR . 28.4 t60 -55.46 -18.33 6.86 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.222 -0.924 . . . . 0.0 109.489 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.54 -41.56 81.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.516 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.0 t80 . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.225 -0.922 . . . . 0.0 109.52 -179.962 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' SER . . . . . 0.519 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 8.2 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.423 0.63 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . 0.473 ' HB3' HD23 ' B' ' 3' ' ' LEU . 1.6 tp10 -60.14 -63.26 1.36 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.838 . . . . 0.0 109.598 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.57 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 3.3 mm? -75.88 -34.83 60.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.63 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . 0.519 ' HB2' ' N ' ' B' ' 1' ' ' SER . 2.7 mm-40 -53.45 -61.98 1.95 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.236 -0.915 . . . . 0.0 109.63 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -60.73 -48.06 83.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.23 -0.919 . . . . 0.0 109.546 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.526 ' CB ' HD13 ' A' ' 10' ' ' LEU . . . -61.11 -14.13 22.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.278 -0.889 . . . . 0.0 109.664 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.515 ' CE ' HG23 ' A' ' 81' ' ' THR . 1.6 mmt -83.05 -64.37 1.18 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 109.6 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -51.35 -25.81 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.493 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -75.89 -57.84 3.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.207 -0.933 . . . . 0.0 109.6 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -49.26 -39.31 30.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.215 -0.928 . . . . 0.0 109.639 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mt -70.46 -35.53 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.209 -0.932 . . . . 0.0 109.665 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 2.6 t70 -69.58 -16.17 63.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 0.0 109.638 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.582 HG13 ' CE2' ' B' ' 73' ' ' PHE . 1.5 t -89.99 -37.99 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.457 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' SG ' ' B' ' 68' ' ' CYS . 46.1 t80 -66.95 -42.08 85.86 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.866 -1.147 . . . . 0.0 109.341 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . 0.43 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -78.85 -49.79 12.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.497 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 30.1 tt0 -53.98 -59.69 4.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.0 109.504 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.585 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 45.5 m-85 -60.43 -47.57 85.55 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.233 -0.917 . . . . 0.0 109.62 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.49 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 97.6 p -61.77 -14.98 37.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.193 -0.942 . . . . 0.0 109.589 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.26 -31.27 66.32 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.444 ' HD2' ' HA ' ' B' ' 17' ' ' TYR . 1.4 mtt-85 -77.33 -10.9 59.72 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -1.128 . . . . 0.0 109.404 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -79.66 170.02 17.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.67 -35.51 35.95 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.513 ' CB ' ' HD2' ' B' ' 26' ' ' LYS . 2.5 t0 -75.38 -24.05 57.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -1.119 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' B' ' 23' ' ' ASP . 6.7 mttp 66.4 25.98 10.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.59 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . 0.516 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -160.69 22.93 0.14 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.558 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CE ' ' HB3' ' B' ' 25' ' ' HIS . 0.1 OUTLIER -168.67 169.03 10.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.24 -0.913 . . . . 0.0 109.513 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.579 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 7.7 mp -122.36 138.73 54.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.883 . . . . 0.0 109.786 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.537 ' CD ' ' OE2' ' B' ' 31' ' ' GLU . 0.2 OUTLIER -89.77 169.02 11.63 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.028 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.447 ' HA ' HD13 ' B' ' 32' ' ' LEU . 2.6 mtmt -42.14 -26.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.037 -1.04 . . . . 0.0 109.854 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.451 ' N ' ' O ' ' B' ' 28' ' ' LYS . 36.3 t -77.88 -51.92 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 110.97 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.579 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -58.16 -38.58 76.88 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.76 -1.212 . . . . 0.0 109.026 -179.377 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.574 ' CD2' ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -58.8 -67.28 0.38 Allowed 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.469 -0.769 . . . . 0.0 108.94 179.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.591 ' CD ' ' CD1' ' B' ' 47' ' ' ILE . 0.1 OUTLIER -41.08 -30.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.3 OUTLIER -63.75 -64.29 0.93 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.303 179.843 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.585 ' CD2' ' CD2' ' B' ' 17' ' ' TYR . 4.2 mm? -46.01 -40.32 10.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.33 -0.856 . . . . 0.0 109.65 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.566 HD12 ' CE1' ' B' ' 76' ' ' PHE . 1.7 mp -62.18 -41.82 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.068 -1.02 . . . . 0.0 109.945 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -82.14 -73.81 0.37 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.033 -1.042 . . . . 0.0 111.394 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . 0.468 ' OD1' ' OH ' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -68.18 -1.15 5.52 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.032 -1.043 . . . . 0.0 111.465 -178.071 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.544 ' CB ' ' O ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -131.03 -9.68 3.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.7 -1.25 . . . . 0.0 110.313 -179.92 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.565 ' CD1' ' CE ' ' A' ' 7' ' ' MET . 1.6 tp -141.48 78.3 1.63 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.705 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.151 -0.968 . . . . 0.0 109.739 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.591 ' CD1' ' CD ' ' B' ' 33' ' ' LYS . 2.0 mt . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.472 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER -42.47 -31.85 0.48 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.753 -179.747 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.472 ' CG ' ' O ' ' B' ' 48' ' ' LYS . 0.9 OUTLIER 171.39 65.27 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.216 -0.928 . . . . 0.0 109.405 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.459 ' HB3' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 47.97 48.35 18.07 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.931 . . . . 0.0 109.193 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.438 ' OE1' ' HG3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.05 -64.1 1.19 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.541 ' CG1' ' CG1' ' B' ' 80' ' ' VAL . 1.3 t -90.83 -20.9 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.19 -0.944 . . . . 0.0 109.692 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.523 ' CG2' HD11 ' B' ' 47' ' ' ILE . 37.6 t -82.92 -31.35 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 120.803 -1.185 . . . . 0.0 108.993 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.459 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.54 -27.67 19.01 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.287 -0.883 . . . . 0.0 109.15 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -86.51 -46.09 10.49 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.333 -0.855 . . . . 0.0 109.447 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.531 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 1.2 p -63.52 -41.41 92.56 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.037 -1.04 . . . . 0.0 108.904 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.516 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.49 -49.25 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.852 -0.53 . . . . 0.0 109.658 179.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -61.7 -44.85 96.14 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.448 ' O ' HG21 ' B' ' 59' ' ' THR . 34.2 m -65.74 -13.74 59.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.436 -0.79 . . . . 0.0 109.793 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.574 ' CD1' ' CD2' ' B' ' 32' ' ' LEU . 2.4 mt -87.17 -44.94 11.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.037 -1.039 . . . . 0.0 109.169 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' B' ' 57' ' ' MET . 8.3 m-20 -42.75 112.35 0.35 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.605 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -44.44 -45.58 9.16 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.31 -0.869 . . . . 0.0 109.611 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -155.18 19.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.169 -0.957 . . . . 0.0 109.762 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.13 95.5 2.28 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 t0 179.8 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.275 -1.132 . . . . 0.0 108.442 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 -21.21 28.94 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' B' ' 26' ' ' LYS . 5.3 mm-40 -69.88 108.1 3.84 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.233 -1.157 . . . . 0.0 109.29 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.556 ' SG ' ' CE1' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -69.69 128.1 35.26 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.215 -0.928 . . . . 0.0 109.727 -179.548 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.512 ' N ' ' OE1' ' B' ' 72' ' ' GLU . 9.1 m-20 -100.55 170.3 8.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.27 -0.894 . . . . 0.0 108.649 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -59.37 5.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.757 -1.214 . . . . 0.0 110.148 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.493 ' HA ' ' HG2' ' B' ' 74' ' ' MET . 2.4 mt-30 -52.44 -24.69 8.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.046 -1.034 . . . . 0.0 109.084 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.537 ' CG ' ' HB3' ' B' ' 60' ' ' LEU . 0.1 OUTLIER -76.95 -38.15 53.85 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.349 -0.845 . . . . 0.0 109.389 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.582 ' CE2' HG13 ' B' ' 13' ' ' VAL . 24.7 t80 -68.46 -48.79 63.6 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.197 -0.939 . . . . 0.0 109.092 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.569 ' HB3' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -54.24 -46.48 72.58 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.307 -0.87 . . . . 0.0 109.337 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.505 ' N ' ' SD ' ' B' ' 74' ' ' MET . . . -74.73 -20.1 59.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.165 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.566 ' CE1' HD12 ' B' ' 36' ' ' ILE . 0.4 OUTLIER -72.73 -71.11 0.31 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 109.233 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.555 HG21 ' CE2' ' B' ' 76' ' ' PHE . 53.1 t -57.54 -31.29 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.111 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.515 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -59.76 -42.06 92.41 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.338 -0.851 . . . . 0.0 109.227 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.527 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 3.9 mmm -73.63 -70.06 0.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 0.0 109.618 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.541 ' CG1' ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.32 -25.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 120.891 -1.13 . . . . 0.0 109.591 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 11.8 m -70.96 -67.74 0.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.973 -1.079 . . . . 0.0 108.885 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.592 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 0.9 OUTLIER -82.98 -52.95 6.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.057 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -36.09 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.261 0.553 . . . . 0.0 109.881 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' B' ' 82' ' ' THR . 41.4 t -72.78 -52.69 13.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.565 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -9.91 50.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.266 -0.896 . . . . 0.0 109.583 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -81.85 -20.15 39.55 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.24 -0.912 . . . . 0.0 109.48 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.489 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.484 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.515 ' HG3' ' CB ' ' B' ' 9' ' ' ALA . 3.0 tt0 -64.32 -50.41 67.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.896 . . . . 0.0 109.468 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.524 ' O ' ' CB ' ' A' ' 7' ' ' MET . 1.2 mp -79.94 -27.5 39.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.57 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.512 ' N ' ' HG3' ' B' ' 39' ' ' GLU . 37.7 tt0 -60.99 -50.54 72.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 109.525 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -52.88 15.62 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.297 -0.877 . . . . 0.0 109.251 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.588 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -61.9 -13.26 23.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.926 . . . . 0.0 109.504 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' MET . . . . . 0.524 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 42.3 ttp -80.09 -59.08 2.85 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.219 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 75.9 t -57.09 -24.51 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.224 -0.923 . . . . 0.0 109.266 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.11 -51.82 9.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' ' CD1' ' B' ' 3' ' ' LEU . 0.4 OUTLIER -57.53 -60.66 3.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 109.426 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.568 HG12 ' CZ ' ' A' ' 70' ' ' PHE . 6.9 mt -53.06 -43.97 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.274 -0.891 . . . . 0.0 109.227 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 9.3 m-20 -54.16 -37.18 64.16 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.375 -0.828 . . . . 0.0 109.247 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.573 HG23 ' CE1' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -66.29 -39.77 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.18 -0.95 . . . . 0.0 109.188 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -53.74 -62.85 1.38 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.985 -1.072 . . . . 0.0 108.286 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -66.19 -10.04 37.61 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.291 -0.881 . . . . 0.0 109.13 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.498 ' HB3' ' CD1' ' A' ' 17' ' ' TYR . 1.7 tp60 -67.26 -66.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 109.91 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -125.05 35.35 4.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.697 -1.252 . . . . 0.0 110.708 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.587 ' HA ' ' CD2' ' A' ' 27' ' ' LEU . 37.6 m -91.4 -22.36 20.51 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.922 -1.111 . . . . 0.0 109.201 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.47 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -103.36 20.72 41.6 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -60.42 -61.91 2.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -1.132 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -122.87 164.83 17.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.431 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.39 -128.62 11.63 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.548 ' CB ' ' NE2' ' A' ' 25' ' ' HIS . 3.9 m-20 -88.99 -148.81 0.18 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -1.144 . . . . 0.0 109.46 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.47 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 14.9 ttpt -145.04 65.81 1.26 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 109.476 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.548 ' NE2' ' CB ' ' A' ' 23' ' ' ASP . 2.8 p80 -170.33 -34.22 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.227 -0.921 . . . . 0.0 109.969 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.522 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -125.46 170.4 11.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.135 -0.978 . . . . 0.0 110.006 -179.524 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.587 ' CD2' ' HA ' ' A' ' 18' ' ' SER . 8.1 mt -104.19 170.52 7.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.425 -0.797 . . . . 0.0 109.929 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -133.54 69.89 1.47 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.317 -0.864 . . . . 0.0 109.667 179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.476 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 65.21 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.59 -0.694 . . . . 0.0 111.064 179.121 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 m -46.14 -42.32 13.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 110.594 -178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.545 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 6.8 mm-40 -59.86 -40.31 88.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.932 -1.105 . . . . 0.0 108.919 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 1.5 mp -55.76 -60.18 3.81 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.528 ' CB ' ' OD1' ' A' ' 37' ' ' ASN . 9.1 mttt -41.56 -50.97 4.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.237 -0.914 . . . . 0.0 109.93 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 38' ' ' ASN . 0.2 OUTLIER -60.23 -39.42 86.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.998 -1.064 . . . . 0.0 110.126 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.633 ' CD2' ' CE2' ' A' ' 17' ' ' TYR . 3.8 mm? -52.71 -56.58 14.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.463 -0.773 . . . . 0.0 110.263 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.629 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 1.9 mp -94.29 -57.02 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 120.93 -1.106 . . . . 0.0 109.788 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.579 ' ND2' ' CD1' ' A' ' 47' ' ' ILE . 1.6 m120 -43.96 -26.19 0.26 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.162 -0.961 . . . . 0.0 109.565 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 34' ' ' GLU . 5.4 t30 -99.82 -41.91 7.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.151 -0.968 . . . . 0.0 109.627 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.524 ' CG ' ' O ' ' A' ' 35' ' ' LEU . 58.0 mm-40 -72.05 -62.78 1.31 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.514 HD12 ' CG2' ' A' ' 36' ' ' ILE . 5.9 mp -41.71 -65.74 0.42 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.394 -0.817 . . . . 0.0 109.57 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.447 179.888 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.579 ' CD1' ' ND2' ' A' ' 37' ' ' ASN . 45.0 mm . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -42.8 -44.09 4.28 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.417 -0.802 . . . . 0.0 109.342 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.49 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -127.47 153.13 46.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.379 -0.826 . . . . 0.0 109.126 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.475 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 1.6 pt20 -85.76 55.55 3.57 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.28 -0.888 . . . . 0.0 109.413 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.52 -45.6 8.84 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 109.954 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -98.66 -25.78 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.035 . . . . 0.0 110.076 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.544 ' CG2' HG13 ' A' ' 47' ' ' ILE . 52.0 t -81.92 -24.73 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.812 -1.18 . . . . 0.0 109.354 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -90.23 -37.06 14.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.167 -0.958 . . . . 0.0 108.916 179.247 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -78.26 -47.39 18.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.426 -0.796 . . . . 0.0 109.268 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.567 HG13 ' CE1' ' A' ' 76' ' ' PHE . 2.9 p -59.12 -44.33 91.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.519 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 10.7 tpt -41.8 -48.76 4.36 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.603 -0.686 . . . . 0.0 109.949 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -57.16 -56.35 22.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.183 -0.948 . . . . 0.0 109.422 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.409 ' O ' ' CG2' ' A' ' 59' ' ' THR . 7.8 m -66.54 -8.67 28.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.306 -0.871 . . . . 0.0 109.574 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.552 HD23 ' CA ' ' A' ' 76' ' ' PHE . 63.7 mt -96.15 -17.29 20.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 -179.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 62' ' ' ASN . 8.9 m-20 -59.1 113.37 2.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.167 -0.958 . . . . 0.0 109.393 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.424 ' OD1' ' OD2' ' A' ' 69' ' ' ASP . 14.5 t30 -43.5 -47.75 7.25 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 109.535 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -165.84 40.86 0.06 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.41 87.8 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.7 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.311 -1.111 . . . . 0.0 108.632 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 -19.22 27.56 Favored Glycine 0 N--CA 1.485 1.94 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.514 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 1.3 mt-10 -71.79 103.2 3.04 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -1.149 . . . . 0.0 109.41 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' CYS . . . . . 0.541 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -70.05 137.02 50.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.303 -0.873 . . . . 0.0 109.258 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 6.5 m-20 -116.85 170.56 8.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.416 -0.803 . . . . 0.0 109.163 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.568 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -52.08 -50.42 61.59 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.056 -1.028 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.499 ' O ' ' HG3' ' A' ' 74' ' ' MET . 0.0 OUTLIER -48.49 -35.73 13.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 109.155 -179.716 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.541 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -78.53 -31.84 47.72 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.969 -1.082 . . . . 0.0 109.369 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -53.55 -51.48 62.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.977 -1.077 . . . . 0.0 108.966 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.537 ' HG2' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -67.13 -38.36 85.42 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.401 -0.812 . . . . 0.0 109.353 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.534 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -68.47 -15.76 63.66 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.081 -1.012 . . . . 0.0 108.866 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.629 ' CD2' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -82.7 -72.29 0.45 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.388 -0.82 . . . . 0.0 109.216 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.501 HG22 ' CD2' ' B' ' 3' ' ' LEU . 54.1 t -54.28 -32.92 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 O-C-N 121.226 -0.921 . . . . 0.0 108.921 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -65.38 -42.02 93.14 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.508 -0.745 . . . . 0.0 109.849 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.555 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 41.6 mmm -77.53 -71.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.914 -1.116 . . . . 0.0 110.089 -179.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.583 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -45.07 -23.14 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 O-C-N 120.436 -1.415 . . . . 0.0 109.83 -178.682 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.492 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 18.5 m -80.77 -66.28 0.9 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.816 -1.178 . . . . 0.0 108.643 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.75 -50.2 10.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 108.596 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.573 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.38 -41.51 0.64 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.758 -0.589 . . . . 0.0 109.739 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 16.4 t -63.78 -49.51 72.66 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.262 -0.899 . . . . 0.0 109.598 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.51 -21.67 64.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.522 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -90.04 -21.98 22.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -76.34 0.09 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 0.0 109.49 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.523 ' O ' ' CB ' ' B' ' 7' ' ' MET . 2.8 mp -62.48 -15.75 51.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.918 . . . . 0.0 109.431 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -73.01 -69.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.402 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -58.97 -49.57 77.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 109.322 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' B' ' 7' ' ' MET . . . -54.89 -56.42 19.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.325 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' MET . . . . . 0.523 ' CB ' ' O ' ' B' ' 3' ' ' LEU . 15.5 ttp -43.83 -39.0 3.59 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.385 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . 0.402 ' HB ' ' O ' ' B' ' 5' ' ' LYS . 87.0 t -61.28 -48.86 87.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.425 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . 0.515 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -62.02 -61.48 2.45 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.565 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' LEU . . . . . 0.588 ' CD2' ' CB ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -43.43 -39.12 3.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.312 -0.867 . . . . 0.0 109.489 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.457 HG12 ' O ' ' B' ' 7' ' ' MET . 13.5 mm -61.66 -51.51 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.128 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 6.9 t0 -58.95 -17.06 21.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.321 -0.862 . . . . 0.0 109.229 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.557 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 1.3 t -76.5 -53.18 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.286 -0.884 . . . . 0.0 109.166 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.8 t80 -55.1 -50.98 67.84 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.812 -1.18 . . . . 0.0 109.384 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -63.84 1.0 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.166 -0.959 . . . . 0.0 109.93 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' B' ' 17' ' ' TYR . 0.9 OUTLIER -45.31 -68.73 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.806 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.574 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 23.4 m-85 -42.73 -34.12 0.86 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.384 -0.822 . . . . 0.0 109.722 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' SER . . . . . 0.536 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -85.69 50.0 1.88 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.19 -0.944 . . . . 0.0 109.294 179.762 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.61 -44.3 1.7 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -23.06 21.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.326 -1.103 . . . . 0.0 109.456 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER -69.84 102.47 1.95 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.213 -0.929 . . . . 0.0 109.504 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . 44.1 -95.84 0.01 OUTLIER Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' B' ' 21' ' ' GLU . 0.4 OUTLIER -112.49 -81.23 0.59 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -1.157 . . . . 0.0 109.411 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' B' ' 18' ' ' SER . 0.1 OUTLIER 175.77 56.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.261 -0.899 . . . . 0.0 109.378 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -136.88 6.63 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.189 -0.944 . . . . 0.0 109.7 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -170.1 170.53 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.126 -0.984 . . . . 0.0 109.689 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.472 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 26.1 mt -126.54 130.74 51.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.235 -0.915 . . . . 0.0 110.122 -179.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' C ' ' B' ' 29' ' ' LYS . 3.2 ttmt -69.67 154.03 42.57 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.477 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -39.45 -32.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.314 -0.866 . . . . 0.0 109.718 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.8 OUTLIER -76.31 -46.58 27.09 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.322 -0.861 . . . . 0.0 109.481 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.472 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -52.67 -42.96 65.21 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.179 -0.951 . . . . 0.0 108.988 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.611 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 5.6 mt -60.3 -66.32 0.54 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.648 -0.657 . . . . 0.0 109.306 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.462 ' O ' ' ND2' ' B' ' 37' ' ' ASN . 0.6 OUTLIER -42.88 -27.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 109.364 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -66.53 -51.59 54.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -0.873 . . . . 0.0 109.329 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . 0.574 ' HG ' ' CE1' ' B' ' 17' ' ' TYR . 2.3 mp -56.77 -42.12 78.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.263 -0.898 . . . . 0.0 109.475 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.555 HD12 ' CZ ' ' B' ' 76' ' ' PHE . 3.4 mt -79.91 -14.13 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.268 -0.895 . . . . 0.0 109.563 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' B' ' 33' ' ' LYS . 0.9 OUTLIER -89.38 -14.73 34.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 109.533 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -99.69 -35.43 9.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 0.0 109.507 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.512 ' HG3' ' N ' ' A' ' 4' ' ' GLU . 3.2 tm-20 -110.31 -10.01 14.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.505 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.524 ' CD2' ' HA ' ' B' ' 81' ' ' THR . 0.3 OUTLIER -131.6 68.08 1.5 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.233 -0.917 . . . . 0.0 109.58 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' ILE . . . . . 0.53 HG23 ' CG2' ' B' ' 53' ' ' VAL . 9.0 mm . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.4 mttt 43.81 32.68 0.62 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.124 -0.985 . . . . 0.0 109.382 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 50.8 tt0 83.14 -43.1 0.11 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.63 -0.668 . . . . 0.0 109.878 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.496 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.8 OUTLIER 176.22 56.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.0 109.645 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . 0.404 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 2.2 tm-20 -90.55 -69.7 0.71 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -0.932 . . . . 0.0 109.529 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.551 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 17.0 t -85.56 -22.22 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.196 -0.94 . . . . 0.0 109.688 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . 0.53 ' CG2' HG23 ' B' ' 47' ' ' ILE . 47.8 t -78.86 -36.02 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.147 -0.97 . . . . 0.0 109.366 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.496 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 23.7 t70 -76.58 -35.66 58.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.252 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -73.53 -45.68 52.22 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.879 . . . . 0.0 109.385 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' VAL . . . . . 0.618 ' CG2' ' CZ ' ' B' ' 76' ' ' PHE . 25.9 m -59.77 -43.36 91.5 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.147 -0.97 . . . . 0.0 109.69 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' MET . . . . . 0.45 ' C ' ' O ' ' B' ' 56' ' ' VAL . 0.0 OUTLIER -41.62 -28.11 0.12 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.972 -1.08 . . . . 0.0 109.419 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.6 tm-20 -83.63 -46.25 12.55 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' THR . . . . . 0.477 ' O ' ' C ' ' B' ' 60' ' ' LEU . 7.5 m -68.76 -65.12 0.74 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 109.054 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . 0.633 ' CD1' ' CD2' ' B' ' 76' ' ' PHE . 21.0 mt -36.44 -62.58 0.45 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.81 -0.556 . . . . 0.0 109.693 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . 0.463 ' OD1' ' HA2' ' B' ' 64' ' ' GLY . 5.1 t70 -56.62 98.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.402 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' ASN . . . . . 0.455 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 3.1 m120 -96.33 -11.17 26.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -105.45 -40.67 5.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -0.922 . . . . 0.0 109.479 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . 0.463 ' HA2' ' OD1' ' B' ' 61' ' ' ASP . . . 101.82 95.39 2.26 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 176.71 -32.48 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.211 -1.17 . . . . 0.0 108.61 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 12.82 16.85 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . 0.521 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 20.0 pt-20 -110.39 116.51 31.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.24 -1.153 . . . . 0.0 109.337 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' CYS . . . . . 0.472 ' O ' ' HA ' ' B' ' 26' ' ' LYS . 9.0 t -73.04 152.77 41.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.2 -0.937 . . . . 0.0 109.765 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . 0.452 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -115.38 171.8 7.48 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -55.34 -51.46 66.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.123 -0.986 . . . . 0.0 110.305 -179.669 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . 0.459 ' OE1' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -59.98 -36.33 76.93 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.314 -0.867 . . . . 0.0 108.975 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.459 ' HG2' ' OE1' ' B' ' 71' ' ' GLN . 3.4 mt-10 -79.82 -13.12 59.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.091 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.567 ' CE2' ' SD ' ' B' ' 74' ' ' MET . 0.0 OUTLIER -73.88 -60.35 2.3 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.654 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' MET . . . . . 0.567 ' SD ' ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -67.78 -24.43 65.32 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.524 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -70.14 -30.54 67.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.301 -0.874 . . . . 0.0 108.731 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.647 ' CD1' ' CG2' ' B' ' 80' ' ' VAL . 0.8 OUTLIER -75.71 -69.02 0.51 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.226 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.482 ' O ' ' CB ' ' B' ' 81' ' ' THR . 42.9 t -49.22 -36.12 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.321 -0.862 . . . . 0.0 109.408 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . 0.537 ' CB ' ' HG2' ' A' ' 74' ' ' MET . . . -66.17 -38.39 87.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.873 . . . . 0.0 110.438 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 58.5 mtm -78.2 -71.35 0.43 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.888 -1.133 . . . . 0.0 109.795 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' VAL . . . . . 0.647 ' CG2' ' CD1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -45.41 -23.49 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 O-C-N 120.452 -1.405 . . . . 0.0 109.585 -179.13 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' THR . . . . . 0.524 ' HA ' ' CD2' ' B' ' 40' ' ' LEU . 11.8 m -79.09 -67.27 0.77 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.926 -1.109 . . . . 0.0 108.678 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' THR . . . . . 0.58 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.2 t -80.71 -50.74 9.5 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.206 -0.934 . . . . 0.0 108.615 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . 0.58 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -38.01 -31.21 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.331 0.586 . . . . 0.0 109.657 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' B' ' 82' ' ' THR . 48.2 t -85.25 -43.59 13.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 0.0 109.516 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' B' ' 82' ' ' THR . 54.4 t-80 -48.07 -33.51 8.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.523 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' B' ' 87' ' ' PHE . 2.0 tt0 -87.97 -28.36 21.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.525 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' PHE . . . . . 0.434 ' HB2' ' HA ' ' B' ' 84' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' B' ' 38' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.459 ' HG3' ' HB3' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -71.88 -59.92 2.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.446 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -72.31 -23.96 61.25 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.455 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.417 ' HB3' ' N ' ' A' ' 1' ' ' SER . 10.6 tm-20 -62.77 -61.25 2.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -41.9 94.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.226 -0.921 . . . . 0.0 109.326 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.509 ' O ' ' CD1' ' A' ' 10' ' ' LEU . . . -66.91 -19.07 65.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.264 -0.898 . . . . 0.0 109.42 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.521 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 2.2 mtp -76.32 -44.13 38.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.401 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -65.94 -38.18 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.501 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -75.04 -65.67 0.85 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.481 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.526 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 0.5 OUTLIER -43.76 -41.24 4.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.448 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.521 ' CG1' ' O ' ' A' ' 7' ' ' MET . 61.9 mt -62.19 -45.23 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -56.99 -27.37 61.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.227 -0.921 . . . . 0.0 109.357 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.581 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -80.01 -28.7 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.266 -0.897 . . . . 0.0 109.068 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 34.4 t80 -66.33 -45.69 79.4 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.055 -1.028 . . . . 0.0 109.45 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.465 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 8.1 m-70 -80.32 -34.55 36.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.597 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.14 -63.38 1.26 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.494 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.449 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 43.8 m-85 -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.522 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 82.9 p -61.18 -21.09 63.48 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.288 -0.883 . . . . 0.0 109.486 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -66.73 -31.99 80.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.3 mmt180 -52.51 -41.56 63.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -1.132 . . . . 0.0 109.477 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 23' ' ' ASP . 43.6 tt0 -76.6 81.89 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.451 ' O ' ' O ' ' A' ' 23' ' ' ASP . . . 43.63 -95.23 0.01 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -57.91 -158.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -1.133 . . . . 0.0 109.448 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.8 pttp -153.93 89.79 1.33 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 109.412 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.564 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -169.05 -36.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.522 ' N ' ' HB2' ' A' ' 18' ' ' SER . 0.0 OUTLIER -122.74 170.11 10.39 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 109.557 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.527 HD21 ' N ' ' A' ' 32' ' ' LEU . 2.9 mp -110.4 143.65 40.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.274 -0.891 . . . . 0.0 109.503 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 30' ' ' SER . 1.5 tttp -98.56 84.64 3.2 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.301 -0.875 . . . . 0.0 109.282 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.507 ' HG2' ' N ' ' A' ' 30' ' ' SER . 29.1 ttmt 43.17 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.425 -0.797 . . . . 0.0 110.847 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' A' ' 28' ' ' LYS . 2.0 t -47.61 -31.89 4.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.156 -0.965 . . . . 0.0 110.06 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -58.85 -45.62 89.63 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.832 -1.168 . . . . 0.0 108.64 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.527 ' N ' HD21 ' A' ' 27' ' ' LEU . 27.1 mt -58.65 -54.95 41.25 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.461 ' HA ' HD13 ' A' ' 36' ' ' ILE . 1.2 tttt -46.31 -42.46 14.69 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.386 -0.821 . . . . 0.0 109.391 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -58.47 7.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.23 -40.25 58.4 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.335 -0.853 . . . . 0.0 109.663 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.578 ' CG2' ' CD1' ' A' ' 47' ' ' ILE . 48.0 mt -61.75 -36.33 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.203 -0.936 . . . . 0.0 109.951 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLU . 6.8 m120 -94.92 -71.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.085 -1.01 . . . . 0.0 109.779 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 37' ' ' ASN . 2.6 t-20 -41.53 -27.08 0.08 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.421 -0.799 . . . . 0.0 110.111 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' CD2' ' A' ' 35' ' ' LEU . 1.6 mm-40 -112.03 -46.14 3.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.09 -1.006 . . . . 0.0 109.726 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.523 ' HB3' ' CD2' ' A' ' 44' ' ' LEU . 9.3 mp -106.9 61.97 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.103 -0.998 . . . . 0.0 109.582 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.3 p -112.06 13.96 20.72 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.218 -0.926 . . . . 0.0 109.409 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.24 -56.15 1.64 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.44 -43.59 93.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.898 . . . . 0.0 109.481 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.523 ' CD2' ' HB3' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -116.84 90.89 3.43 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.236 -0.915 . . . . 0.0 109.557 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -85.6 9.66 15.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.249 -0.907 . . . . 0.0 109.453 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.463 ' CG ' ' N ' ' A' ' 47' ' ' ILE . 4.5 pm0 -67.83 -136.31 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.282 -0.886 . . . . 0.0 109.407 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.578 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 1.1 mt 64.75 -146.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.968 -1.082 . . . . 0.0 109.213 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.568 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 12.5 mttt 83.59 -44.58 0.11 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.553 -0.717 . . . . 0.0 109.367 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 60.9 mm-40 -110.32 14.69 22.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.238 -0.914 . . . . 0.0 109.03 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.536 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.4 mt-30 78.34 59.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.711 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 3.7 mp0 -90.08 -70.6 0.66 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.215 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.525 ' CG1' HG11 ' A' ' 80' ' ' VAL . 1.3 t -91.44 -21.18 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.126 -0.984 . . . . 0.0 108.629 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.515 ' CG2' HD11 ' A' ' 36' ' ' ILE . 55.2 t -73.22 -30.73 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.368 -0.832 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.46 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -90.09 -40.42 12.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.405 -0.809 . . . . 0.0 109.113 179.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -64.41 -35.5 81.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.326 -0.859 . . . . 0.0 109.272 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.509 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 4.4 m -55.38 -56.54 11.17 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.263 -0.898 . . . . 0.0 109.716 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.455 ' C ' ' O ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -41.49 -28.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.001 -1.062 . . . . 0.0 109.626 -179.768 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.1 tp10 -69.59 -55.99 8.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.285 -0.884 . . . . 0.0 108.788 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.468 ' O ' ' C ' ' A' ' 60' ' ' LEU . 9.6 m -81.28 -61.68 1.88 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 108.877 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.528 ' CD2' ' HB2' ' A' ' 76' ' ' PHE . 6.5 mp -37.82 -36.43 0.19 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.695 -0.628 . . . . 0.0 109.79 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 57' ' ' MET . 28.0 t0 -89.98 95.73 10.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.213 -0.93 . . . . 0.0 109.433 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -109.69 11.23 24.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.248 -0.908 . . . . 0.0 109.498 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -120.97 -30.21 4.44 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.518 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.33 90.77 0.56 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.87 -32.47 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.271 -1.135 . . . . 0.0 108.618 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.2 31.15 Favored Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 21.9 mt-10 -88.25 107.12 18.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -1.166 . . . . 0.0 109.402 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CD1' ' A' ' 32' ' ' LEU . 4.3 m -69.82 143.58 52.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.256 -0.902 . . . . 0.0 109.797 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.0 m-20 -116.62 169.5 9.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.487 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -51.0 -47.48 61.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.233 -0.917 . . . . 0.0 110.072 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.462 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 16.6 mt-30 -47.92 -42.09 26.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.44 -0.787 . . . . 0.0 109.582 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -79.03 -25.02 43.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.163 -0.961 . . . . 0.0 109.979 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 10.4 t80 -59.3 -58.32 9.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.069 -1.019 . . . . 0.0 109.407 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.554 ' CB ' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -68.36 -49.73 58.15 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.233 -0.917 . . . . 0.0 109.46 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.96 -23.47 19.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.117 -0.99 . . . . 0.0 108.973 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.577 ' CE1' HG22 ' A' ' 80' ' ' VAL . 2.2 t80 -70.3 -63.67 1.04 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.509 ' O ' ' CB ' ' A' ' 81' ' ' THR . 3.3 t -52.91 -23.57 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.55 ' CB ' ' CB ' ' B' ' 74' ' ' MET . . . -62.33 -54.23 43.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.421 -0.799 . . . . 0.0 108.865 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.556 ' O ' ' N ' ' A' ' 83' ' ' ALA . 1.4 mmm -70.52 -69.44 0.36 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.379 -0.825 . . . . 0.0 109.479 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.577 HG22 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.03 -25.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 120.567 -1.333 . . . . 0.0 110.129 -179.416 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.515 ' N ' ' O ' ' A' ' 79' ' ' MET . 3.2 m -76.36 -69.98 0.47 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.919 -1.113 . . . . 0.0 108.512 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.572 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.6 t -78.04 -49.91 13.09 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.572 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.95 -47.75 1.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.455 ' SG ' ' OE2' ' A' ' 46' ' ' GLU . 9.2 t -61.27 -47.12 87.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.471 -0.768 . . . . 0.0 109.286 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -9.93 51.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.25 -0.906 . . . . 0.0 109.488 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 87' ' ' PHE . 0.8 OUTLIER -82.68 -21.06 35.05 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.313 -0.867 . . . . 0.0 109.498 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -44.08 -26.53 0.3 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.25 -0.906 . . . . 0.0 109.486 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.403 ' N ' ' O ' ' A' ' 86' ' ' GLU . 18.6 m-85 -74.37 -54.11 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.459 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -93.65 131.36 39.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.5 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -138.7 112.55 8.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 109.437 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.478 -179.967 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.51 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.467 ' HB3' HD23 ' B' ' 3' ' ' LEU . 1.3 tp10 -70.38 -55.35 9.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.526 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 3.1 mm? -75.44 -27.64 59.02 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 0.0 109.39 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.51 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 2.8 tm-20 -67.15 -61.55 1.87 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.82 -49.3 71.37 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.92 . . . . 0.0 109.41 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.517 ' HB2' ' CD1' ' A' ' 10' ' ' LEU . . . -65.02 -22.59 67.02 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.289 -0.882 . . . . 0.0 109.453 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.49 ' CG ' HD13 ' B' ' 11' ' ' ILE . 5.3 ttt -68.95 -42.61 76.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.427 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.8 t -70.34 -34.16 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.217 -0.927 . . . . 0.0 109.433 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.459 ' HB3' ' HG3' ' A' ' 2' ' ' GLU . . . -65.73 -64.46 0.86 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.243 -0.911 . . . . 0.0 109.472 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.505 ' HB3' ' CE2' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -50.74 -47.94 59.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.473 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.49 HD13 ' CG ' ' B' ' 7' ' ' MET . 88.7 mt -56.42 -36.0 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.179 -0.951 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.7 OUTLIER -67.6 -29.85 69.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.244 -0.91 . . . . 0.0 109.439 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.577 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 10.8 t -75.72 -25.02 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.4 t80 -74.69 -50.95 15.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.996 -1.065 . . . . 0.0 109.478 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 15.6 m80 -78.28 -20.82 50.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.25 -0.906 . . . . 0.0 109.832 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 53.3 tt0 -83.13 -60.29 2.2 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.139 -0.976 . . . . 0.0 109.565 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.609 ' CD2' ' CD1' ' B' ' 35' ' ' LEU . 28.0 m-85 -63.32 -28.18 69.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.889 . . . . 0.0 109.541 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.513 ' HB2' ' N ' ' B' ' 25' ' ' HIS . 84.6 p -71.09 -20.48 62.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.189 -0.945 . . . . 0.0 109.69 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.96 30.28 10.71 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.515 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.14 -59.49 2.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -1.144 . . . . 0.0 109.529 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 22' ' ' GLY . 0.2 OUTLIER -114.74 97.54 6.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.9 . . . . 0.0 109.513 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 49.78 -179.85 0.02 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' B' ' 22' ' ' GLY . 81.0 m-20 52.06 174.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -1.162 . . . . 0.0 109.452 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -172.44 59.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.24 -0.912 . . . . 0.0 109.511 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.513 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -169.2 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.275 -0.891 . . . . 0.0 109.542 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.471 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 1.4 mptt -122.97 160.75 25.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 109.54 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.519 ' CB ' ' HB2' ' B' ' 31' ' ' GLU . 3.8 mp -109.27 132.29 54.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.928 . . . . 0.0 109.584 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -79.73 170.12 16.98 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -45.82 -25.01 0.45 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.879 -1.138 . . . . 0.0 109.324 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.496 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 0.2 OUTLIER -82.28 -50.54 8.84 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.646 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.519 ' HB2' ' CB ' ' B' ' 27' ' ' LEU . 43.0 mt-10 -56.68 -38.65 72.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.13 . . . . 0.0 109.402 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.521 ' CD1' ' HE1' ' B' ' 57' ' ' MET . 16.0 mt -65.02 -57.44 8.68 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.594 -0.691 . . . . 0.0 109.293 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.571 ' CD ' ' CG1' ' B' ' 53' ' ' VAL . 0.1 OUTLIER -42.27 -50.29 4.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.339 -0.851 . . . . 0.0 109.497 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -51.58 -61.62 2.13 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.188 -0.945 . . . . 0.0 109.151 179.736 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.609 ' CD1' ' CD2' ' B' ' 17' ' ' TYR . 1.1 tp -43.47 -38.1 2.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.311 -0.868 . . . . 0.0 109.43 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.627 ' CD1' ' CZ ' ' B' ' 76' ' ' PHE . 3.0 mm -57.18 -49.93 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.229 -0.919 . . . . 0.0 109.586 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' B' ' 39' ' ' GLU . 51.1 m-80 -93.01 -65.35 1.0 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 109.807 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.454 ' O ' ' OG ' ' A' ' 1' ' ' SER . 0.6 OUTLIER -41.14 -26.92 0.06 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.412 -0.805 . . . . 0.0 110.265 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' B' ' 35' ' ' LEU . 3.9 mm-40 -118.73 -40.54 2.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.987 -1.071 . . . . 0.0 109.986 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 5.3 mp -108.14 67.11 0.66 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.094 -1.004 . . . . 0.0 109.596 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 28.1 t -107.84 26.56 10.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 109.417 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.81 -77.28 0.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.917 . . . . 0.0 109.502 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -85.52 -8.44 58.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.897 . . . . 0.0 109.554 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.518 ' CD1' ' HB3' ' B' ' 40' ' ' LEU . 3.1 mp -105.9 -12.36 15.87 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.198 -0.938 . . . . 0.0 109.473 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 48.75 -150.97 0.15 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.443 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' B' ' 47' ' ' ILE . 55.0 mm-40 -86.32 58.68 5.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 109.397 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.52 ' CD1' HG23 ' B' ' 36' ' ' ILE . 10.5 mm 57.26 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.31 -0.869 . . . . 0.0 109.437 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.1 mmtp -111.28 55.33 0.66 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.501 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 3.0 tp10 74.31 41.79 0.36 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.261 -0.9 . . . . 0.0 109.353 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 72.51 51.48 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.304 -0.872 . . . . 0.0 109.447 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.458 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 24.7 tt0 -88.65 -70.16 0.66 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.492 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.528 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.4 t -87.47 -21.21 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.349 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.571 ' CG1' ' CD ' ' B' ' 33' ' ' LYS . 77.0 t -73.54 -26.06 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.207 -0.933 . . . . 0.0 109.27 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -85.16 -47.95 9.62 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 109.438 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 14.0 mttt -62.58 -41.9 99.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.213 -0.929 . . . . 0.0 109.395 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 31.1 m -59.28 -49.34 83.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 O-C-N 121.196 -0.94 . . . . 0.0 109.474 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.521 ' HE1' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -44.5 -26.38 0.35 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.977 -1.077 . . . . 0.0 109.453 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' B' ' 55' ' ' LYS . 0.8 OUTLIER -77.08 -45.79 25.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.224 -0.922 . . . . 0.0 108.994 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.443 ' O ' ' C ' ' B' ' 60' ' ' LEU . 66.5 m -84.31 -63.81 1.27 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.312 -0.867 . . . . 0.0 109.371 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.539 ' CG ' ' HB2' ' B' ' 76' ' ' PHE . 9.1 mp -41.73 -27.86 0.12 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.585 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' B' ' 57' ' ' MET . 3.6 m-20 -63.55 114.68 4.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.256 -0.903 . . . . 0.0 109.333 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' B' ' 67' ' ' GLU . 2.6 t-20 -42.77 -44.31 4.34 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.386 -0.821 . . . . 0.0 109.623 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.73 28.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.245 -0.909 . . . . 0.0 109.566 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.3 90.87 1.18 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' B' ' 65' ' ' ASP . 43.5 t0 -179.34 -34.44 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.11 . . . . 0.0 108.581 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.12 38.65 1.64 Allowed Glycine 0 N--CA 1.485 1.912 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' B' ' 62' ' ' ASN . 15.2 pt-20 -141.09 105.74 4.9 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.205 -1.174 . . . . 0.0 109.469 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.471 ' N ' ' HB3' ' B' ' 26' ' ' LYS . 12.2 t -78.59 153.4 31.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.256 -0.902 . . . . 0.0 109.748 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.464 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -110.13 171.16 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -61.27 -48.95 79.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.155 -0.965 . . . . 0.0 109.973 -179.804 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.455 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 9.4 mp0 -54.84 -40.19 69.35 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 108.953 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.464 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 1.2 mt-10 -78.83 -18.47 53.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.407 -0.808 . . . . 0.0 109.527 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.505 ' CE2' ' HB3' ' B' ' 10' ' ' LEU . 3.5 t80 -67.25 -62.14 1.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.181 -0.949 . . . . 0.0 109.046 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.55 ' CB ' ' CB ' ' A' ' 78' ' ' ALA . 1.8 tpp -63.51 -48.04 79.23 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.108 -0.995 . . . . 0.0 108.978 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.454 ' O ' ' HB1' ' B' ' 78' ' ' ALA . . . -51.54 -36.47 45.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.161 -0.962 . . . . 0.0 108.622 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.627 ' CZ ' ' CD1' ' B' ' 36' ' ' ILE . 0.2 OUTLIER -57.86 -62.95 1.44 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.235 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.599 ' N ' ' CD2' ' B' ' 76' ' ' PHE . 3.5 t -49.74 -27.9 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.554 ' CB ' ' CB ' ' A' ' 74' ' ' MET . . . -58.4 -54.56 45.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.387 -0.821 . . . . 0.0 109.093 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' N ' ' B' ' 83' ' ' ALA . 54.7 mtm -71.47 -68.84 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.365 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.588 HG22 ' CZ ' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -40.6 -26.48 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 120.602 -1.311 . . . . 0.0 110.036 -179.637 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.517 ' N ' ' O ' ' B' ' 79' ' ' MET . 3.7 m -75.11 -70.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.993 -1.067 . . . . 0.0 108.7 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.7 t -78.08 -49.63 13.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.124 -0.985 . . . . 0.0 108.455 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.577 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.78 -44.22 0.72 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.752 -0.592 . . . . 0.0 109.71 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.37 -28.86 19.5 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.571 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' B' ' 81' ' ' THR . 0.8 OUTLIER -65.54 -70.06 0.26 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' B' ' 85' ' ' HIS . 0.0 OUTLIER -43.95 -28.32 0.45 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.505 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' B' ' 88' ' ' PHE . 11.2 t80 -44.99 -54.04 7.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.202 -0.936 . . . . 0.0 109.417 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.502 ' O ' ' N ' ' B' ' 90' ' ' HIS . 89.3 t80 -43.99 -45.75 7.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' B' ' 88' ' ' PHE . 0.7 OUTLIER -44.18 96.13 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.248 -0.907 . . . . 0.0 109.463 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.502 ' N ' ' O ' ' B' ' 88' ' ' PHE . 0.2 OUTLIER -94.13 147.24 23.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.273 -0.892 . . . . 0.0 109.467 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.456 -179.986 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.515 ' HB2' ' CB ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.522 ' HG3' ' CB ' ' B' ' 9' ' ' ALA . 0.5 OUTLIER -68.28 -79.45 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.525 HD12 ' CD2' ' B' ' 35' ' ' LEU . 4.9 mp -68.13 -23.04 64.85 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.164 -0.96 . . . . 0.0 109.421 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.515 ' CB ' ' HB2' ' A' ' 1' ' ' SER . 0.2 OUTLIER -63.3 -60.84 2.86 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.23 -0.918 . . . . 0.0 109.229 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.1 tttt -60.73 -29.58 69.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.342 -0.848 . . . . 0.0 109.182 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' CB ' ' HB3' ' B' ' 6' ' ' ALA . . . -71.42 -26.72 62.87 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.34 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.457 ' O ' HG13 ' A' ' 11' ' ' ILE . 1.9 ttm -75.62 -38.71 58.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.332 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.84 -39.49 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.313 -0.867 . . . . 0.0 109.433 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' HB3' ' B' ' 2' ' ' GLU . . . -72.85 -62.93 1.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 109.508 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.524 HD21 ' CZ ' ' A' ' 73' ' ' PHE . 48.7 mt -44.12 -43.69 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.385 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 7' ' ' MET . 62.3 mt -56.75 -53.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.5 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -54.51 -22.78 13.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.578 ' CG1' ' CD1' ' A' ' 35' ' ' LEU . 4.2 t -82.58 -33.7 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.29 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.547 ' CZ ' ' N ' ' A' ' 70' ' ' PHE . 9.9 t80 -63.12 -47.46 82.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.055 -1.028 . . . . 0.0 109.523 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -80.72 -46.33 15.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 109.712 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -54.52 -62.45 1.65 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 109.669 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.576 ' CD2' ' HG ' ' A' ' 35' ' ' LEU . 30.2 m-85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.657 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 26.2 m -60.16 -21.43 61.65 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.158 -0.964 . . . . 0.0 109.617 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.66 30.28 10.75 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.504 ' CG ' ' HA ' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.01 -50.78 5.82 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -1.17 . . . . 0.0 109.511 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . 81.3 mt-10 -134.72 83.99 2.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.258 -0.901 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.82 -170.81 54.94 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' HD2' ' A' ' 24' ' ' LYS . 88.7 m-20 47.75 -169.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.313 -1.11 . . . . 0.0 109.502 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.418 ' C ' ' HB3' ' A' ' 18' ' ' SER . 0.3 OUTLIER -169.31 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.491 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -108.08 16.15 23.61 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.251 -0.906 . . . . 0.0 109.44 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -151.14 170.14 20.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.209 -0.932 . . . . 0.0 109.452 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.547 ' CG ' ' HB3' ' A' ' 31' ' ' GLU . 3.0 mp -108.46 141.22 40.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.88 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.607 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.8 OUTLIER -91.15 79.19 5.77 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 109.079 179.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.586 ' CG ' ' CG ' ' A' ' 57' ' ' MET . 0.0 OUTLIER 41.53 -83.03 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.578 -0.701 . . . . 0.0 111.17 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.607 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -49.24 -27.43 3.73 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.669 -1.269 . . . . 0.0 109.711 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HB3' ' CG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -60.31 -46.19 90.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.916 -1.115 . . . . 0.0 108.617 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.528 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 7.0 mt -59.75 -51.76 68.39 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HG3' ' CG1' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -46.36 -36.53 6.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 109.338 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -53.49 43.89 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.592 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.58 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 4.7 mt -50.72 -52.52 39.63 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.713 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.598 ' CD1' ' CE2' ' A' ' 76' ' ' PHE . 1.9 mp -66.51 -24.59 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.262 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -90.98 -3.72 57.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.222 -0.924 . . . . 0.0 109.615 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -114.05 -14.42 12.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.239 -0.913 . . . . 0.0 109.496 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.527 ' CG ' ' HG ' ' A' ' 40' ' ' LEU . 5.9 pt-20 -120.94 -14.93 8.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.483 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.528 ' HB3' ' CG ' ' A' ' 44' ' ' LEU . 23.8 mt -120.2 75.12 1.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.88 68.12 1.46 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.477 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -51.31 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.496 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.23 -77.1 0.55 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.21 -0.931 . . . . 0.0 109.393 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.528 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 2.4 pp -68.4 112.94 5.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.335 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -125.81 2.75 7.42 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.212 -0.93 . . . . 0.0 109.709 -179.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.571 ' OE2' ' CG ' ' A' ' 87' ' ' PHE . 6.1 tt0 -44.42 -37.16 3.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.539 ' O ' ' CG ' ' A' ' 48' ' ' LYS . 43.4 mt -63.24 -83.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 109.485 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 7.4 pttm 40.24 28.48 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.636 -0.665 . . . . 0.0 109.877 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 5.8 tt0 170.56 -78.83 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -0.873 . . . . 0.0 109.3 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 14.1 pt20 -168.04 26.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.874 . . . . 0.0 109.518 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.25 -69.28 0.3 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.234 -0.916 . . . . 0.0 109.413 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.537 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 1.6 t -86.67 -21.13 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 109.342 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.528 HG22 ' CD1' ' A' ' 47' ' ' ILE . 41.3 t -77.02 -19.29 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.286 -0.884 . . . . 0.0 109.762 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 53.9 t0 -90.06 -36.5 14.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.181 -0.949 . . . . 0.0 109.598 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -79.74 -38.01 34.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.544 HG23 ' CZ ' ' A' ' 76' ' ' PHE . 30.8 m -60.43 -43.74 94.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.193 -0.942 . . . . 0.0 109.773 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.586 ' CG ' ' CG ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -39.78 -29.08 0.05 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.078 -1.014 . . . . 0.0 109.488 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.495 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -87.04 -42.56 12.99 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.811 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.539 ' CG2' ' CE ' ' A' ' 79' ' ' MET . 98.9 m -70.03 -64.92 0.8 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.79 . . . . 0.0 109.587 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.64 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 7.3 mt -38.4 -60.43 0.79 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.474 -0.766 . . . . 0.0 109.589 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.41 112.26 6.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.271 -0.893 . . . . 0.0 109.534 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -120.02 16.67 12.5 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.415 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.24 -47.87 2.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 92.17 2.18 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.89 -35.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -1.126 . . . . 0.0 108.567 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.12 22.83 6.66 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HB2' ' HG3' ' A' ' 26' ' ' LYS . 19.5 pt-20 -128.44 118.54 23.28 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -1.119 . . . . 0.0 109.437 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.82 132.51 46.17 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.25 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' OD1' ' CG ' ' A' ' 71' ' ' GLN . 1.2 p30 -104.59 169.62 8.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.301 -0.874 . . . . 0.0 108.97 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.547 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.19 -47.99 54.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.059 -1.026 . . . . 0.0 110.105 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 75' ' ' ALA . 14.1 pt20 -52.48 -37.5 57.35 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.672 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.524 ' OE2' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -82.38 -20.5 37.04 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.065 -1.022 . . . . 0.0 109.775 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.524 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 1.6 t80 -66.66 -64.27 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.133 -0.979 . . . . 0.0 109.061 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.529 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.9 -32.82 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.384 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' A' ' 71' ' ' GLN . . . -65.33 -31.71 72.98 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.263 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.64 ' CD2' ' CD1' ' A' ' 60' ' ' LEU . 1.1 t80 -70.44 -59.22 2.98 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.293 -0.879 . . . . 0.0 108.976 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.463 ' O ' ' OG1' ' A' ' 81' ' ' THR . 41.4 t -56.57 -25.39 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.54 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -64.67 -49.2 71.9 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.383 -0.823 . . . . 0.0 109.369 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.562 ' O ' ' N ' ' A' ' 83' ' ' ALA . 2.3 mtm -71.94 -70.76 0.31 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.333 -0.855 . . . . 0.0 109.682 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.596 HG23 ' CD1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.91 -25.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 O-C-N 120.623 -1.298 . . . . 0.0 110.242 -179.187 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.482 ' N ' ' O ' ' A' ' 79' ' ' MET . 3.8 m -74.91 -68.03 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.875 -1.141 . . . . 0.0 108.589 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.588 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.8 m -81.68 -51.48 8.15 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -37.07 -40.64 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.206 0.527 . . . . 0.0 109.913 179.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.486 ' SG ' ' CB ' ' A' ' 46' ' ' GLU . 12.0 t -79.02 -40.89 30.22 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.605 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.2 OUTLIER -64.98 -11.89 43.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.139 -0.975 . . . . 0.0 109.477 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.45 ' OE2' HG21 ' A' ' 82' ' ' THR . 0.5 OUTLIER -90.31 -36.0 14.93 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.571 ' CG ' ' OE2' ' A' ' 46' ' ' GLU . 2.9 m-85 -43.86 -27.06 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 0.0 109.535 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -66.25 -50.81 62.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.272 -0.893 . . . . 0.0 109.376 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.99 172.94 15.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.277 -0.89 . . . . 0.0 109.465 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' O ' ' OXT' ' A' ' 91' ' ' GLU . 26.0 m-70 -81.24 172.97 12.98 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.525 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.422 ' OE1' ' O ' ' A' ' 91' ' ' GLU . 1.9 tm-20 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.526 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 6.4 mm-40 -71.22 -63.47 1.1 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.248 -0.907 . . . . 0.0 109.386 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.58 ' CD1' ' CD2' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.18 -25.32 63.38 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.43 -65.6 0.67 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.317 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.413 ' HA ' HG13 ' B' ' 8' ' ' VAL . 0.1 OUTLIER -62.97 -37.06 85.58 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.273 -0.892 . . . . 0.0 109.25 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.519 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . . . -68.71 -17.23 64.03 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.411 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.25 -39.86 20.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.503 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.471 ' O ' HG21 ' B' ' 11' ' ' ILE . 2.4 p -68.97 -31.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.17 -0.956 . . . . 0.0 109.449 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.522 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -83.3 -50.42 8.4 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 3' ' ' LEU . 5.4 mt -57.75 -34.71 69.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.578 HG12 ' CZ ' ' B' ' 70' ' ' PHE . 0.0 OUTLIER -73.26 -47.61 46.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.15 -0.969 . . . . 0.0 109.402 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.543 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 65.8 t0 -57.34 -19.96 25.83 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.124 -0.985 . . . . 0.0 108.894 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.557 HG21 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -88.14 -41.94 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.37 -0.831 . . . . 0.0 109.632 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.473 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 34.2 t80 -53.93 -42.89 69.3 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.887 -1.133 . . . . 0.0 109.041 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.417 ' O ' ' C ' ' B' ' 16' ' ' GLN . 8.3 t-160 -77.58 -38.65 47.88 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.346 -0.846 . . . . 0.0 109.281 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' B' ' 15' ' ' HIS . 0.9 OUTLIER -44.03 -48.61 8.83 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 108.958 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.585 ' CE2' ' HG ' ' B' ' 35' ' ' LEU . 12.7 m-85 -92.47 -70.27 0.7 Allowed 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.403 -0.811 . . . . 0.0 109.107 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 4.1 p 38.87 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.594 -0.691 . . . . 0.0 109.99 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 88.12 44.19 5.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.428 ' C ' ' O ' ' B' ' 19' ' ' GLY . 0.1 OUTLIER -42.49 -27.42 0.16 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -1.042 . . . . 0.0 109.625 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.449 ' O ' ' HE2' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -100.05 69.91 1.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.03 -115.51 2.34 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' B' ' 19' ' ' GLY . 70.6 m-20 -61.85 148.61 42.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -1.17 . . . . 0.0 109.551 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.9 tttt -119.29 34.6 5.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.258 -0.901 . . . . 0.0 109.512 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.52 ' HB2' ' CE ' ' B' ' 26' ' ' LYS . 33.9 m170 -136.98 8.84 3.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.52 ' CE ' ' HB2' ' B' ' 25' ' ' HIS . 0.3 OUTLIER -169.95 156.24 6.03 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.537 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 9.8 mt -85.08 147.5 26.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -125.63 85.75 2.44 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.839 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' B' ' 30' ' ' SER . 12.6 tppt? 60.97 -86.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.361 -0.837 . . . . 0.0 110.211 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.518 ' N ' ' HG3' ' B' ' 29' ' ' LYS . 7.2 m -44.04 -52.49 7.07 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.172 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -55.91 -38.42 70.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.12 -0.987 . . . . 0.0 109.469 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.506 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 36.7 mt -61.25 -70.17 0.2 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.579 -0.701 . . . . 0.0 109.291 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.1 OUTLIER -44.85 -24.61 0.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.687 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.446 ' OE1' ' O ' ' B' ' 30' ' ' SER . 0.1 OUTLIER -71.52 -69.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.134 -0.979 . . . . 0.0 109.537 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.585 ' HG ' ' CE2' ' B' ' 17' ' ' TYR . 2.4 mt -43.99 -47.91 8.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.305 -0.872 . . . . 0.0 109.732 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.577 ' CG2' ' CD1' ' B' ' 47' ' ' ILE . 11.6 mm -60.93 -43.07 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.656 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.457 ' HA ' ' HB3' ' B' ' 41' ' ' SER . 13.5 m-80 -90.18 8.38 33.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' B' ' 34' ' ' GLU . 2.1 t30 -94.0 -46.25 7.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.199 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.511 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 3.8 mp0 -124.64 -9.9 7.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.896 . . . . 0.0 109.601 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.461 HD21 HD23 ' B' ' 44' ' ' LEU . 5.2 mp -112.93 37.38 3.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.203 -0.935 . . . . 0.0 109.496 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.457 ' HB3' ' HA ' ' B' ' 37' ' ' ASN . 2.9 p -115.13 10.7 16.16 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.185 -0.947 . . . . 0.0 109.489 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -115.52 -28.8 6.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.209 -0.932 . . . . 0.0 109.474 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -97.57 -72.48 0.64 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.208 -0.933 . . . . 0.0 109.524 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.496 ' CB ' ' SG ' ' B' ' 84' ' ' CYS . 0.5 OUTLIER -68.58 105.0 2.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.194 -0.942 . . . . 0.0 109.415 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.45 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 1.5 pt-20 -98.34 16.4 21.68 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.259 -0.901 . . . . 0.0 109.566 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.444 ' HB2' ' SG ' ' B' ' 84' ' ' CYS . 0.5 OUTLIER -76.14 -49.26 17.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.184 -0.947 . . . . 0.0 109.387 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.577 ' CD1' ' CG2' ' B' ' 36' ' ' ILE . 43.7 mt -48.83 -92.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.872 . . . . 0.0 109.396 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.489 ' N ' HG23 ' B' ' 47' ' ' ILE . 16.0 mtmt 43.54 27.02 0.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.251 -0.906 . . . . 0.0 109.516 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 170.85 -75.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.409 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -169.62 27.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.218 -0.926 . . . . 0.0 109.553 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.79 -70.24 0.27 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.217 -0.927 . . . . 0.0 109.303 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.534 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 2.0 t -87.76 -14.72 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.195 -0.941 . . . . 0.0 109.258 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.419 HG23 ' HG3' ' B' ' 33' ' ' LYS . 43.1 t -77.73 -19.16 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.116 -0.99 . . . . 0.0 109.249 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -90.09 -37.18 14.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.227 -0.921 . . . . 0.0 109.284 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -47.5 20.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.309 -0.869 . . . . 0.0 109.352 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.566 ' HB ' ' CE1' ' B' ' 76' ' ' PHE . 31.1 m -55.3 -46.2 78.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.229 -0.919 . . . . 0.0 109.63 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.506 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -43.16 -47.47 6.23 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.204 -0.935 . . . . 0.0 109.887 -179.675 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.17 -56.42 21.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 109.824 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.509 HG22 ' CE ' ' B' ' 79' ' ' MET . 4.7 t -67.64 -9.43 43.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.201 -0.937 . . . . 0.0 109.803 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.642 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -97.95 -11.47 23.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 0.0 109.52 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.438 ' OD2' ' SD ' ' B' ' 57' ' ' MET . 48.9 m-20 -83.47 114.78 21.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.355 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -101.24 -17.31 16.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.935 . . . . 0.0 109.67 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -141.06 8.97 2.1 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.157 -0.965 . . . . 0.0 109.741 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.455 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 71.79 94.48 0.08 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 1.0 OUTLIER 169.22 -28.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.333 -1.098 . . . . 0.0 108.45 -179.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.48 -5.69 29.84 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.503 ' HB3' ' CD ' ' B' ' 26' ' ' LYS . 1.8 mm-40 -69.91 110.34 4.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -1.147 . . . . 0.0 109.219 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 14.3 t -87.89 156.49 19.34 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.179 -0.951 . . . . 0.0 109.675 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.452 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.6 OUTLIER -116.33 170.9 8.19 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.588 ' CG ' ' OG1' ' A' ' 82' ' ' THR . 1.2 t80 -57.73 -51.58 68.97 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.197 -0.94 . . . . 0.0 110.167 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.53 ' HA ' ' CB ' ' A' ' 78' ' ' ALA . 4.0 pt20 -53.81 -44.05 69.87 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.466 -0.771 . . . . 0.0 109.3 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' B' ' 76' ' ' PHE . 3.3 mt-10 -74.05 -19.37 60.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.328 -0.857 . . . . 0.0 109.617 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.494 ' CZ ' ' CG1' ' B' ' 13' ' ' VAL . 12.6 t80 -65.7 -63.1 1.17 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.244 -0.91 . . . . 0.0 109.178 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.54 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.5 OUTLIER -58.65 -46.07 87.93 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.196 -0.94 . . . . 0.0 108.743 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.465 ' HB1' ' HA ' ' A' ' 75' ' ' ALA . . . -58.44 -26.53 63.43 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.221 -0.924 . . . . 0.0 108.525 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CD2' ' CD2' ' B' ' 60' ' ' LEU . 1.0 OUTLIER -64.17 -69.26 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.489 ' O ' ' CB ' ' B' ' 81' ' ' THR . 39.3 t -51.68 -23.65 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.437 -0.789 . . . . 0.0 109.122 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.529 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -63.95 -45.58 88.51 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.289 -0.882 . . . . 0.0 109.304 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.544 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 42.7 mtm -78.03 -64.35 1.18 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.89 . . . . 0.0 109.677 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.614 ' CG2' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -46.89 -23.04 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 O-C-N 120.481 -1.387 . . . . 0.0 109.526 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.489 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 4.8 m -78.85 -67.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.04 -1.037 . . . . 0.0 109.113 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.2 t -77.1 -49.3 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.0 109.037 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.563 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.92 -39.86 0.25 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.747 -0.595 . . . . 0.0 109.966 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' B' ' 44' ' ' LEU . 29.6 t -67.55 -49.38 63.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.242 -0.911 . . . . 0.0 109.554 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -9.93 51.73 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.564 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 87' ' ' PHE . 1.6 tm-20 -89.9 -23.65 21.56 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.229 -0.919 . . . . 0.0 109.525 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' B' ' 86' ' ' GLU . 3.4 t80 -44.15 -44.93 8.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -90.0 -20.37 23.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.895 . . . . 0.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 55.83 -173.2 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.258 -0.901 . . . . 0.0 109.476 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 121.48 24.23 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.468 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.401 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 1.2 m . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.527 ' CG ' HD23 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -62.1 -39.2 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.257 -0.902 . . . . 0.0 109.612 -179.913 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.552 ' N ' ' CD2' ' A' ' 3' ' ' LEU . 3.2 mm? -80.56 -28.52 37.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.24 -0.912 . . . . 0.0 109.551 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 8.8 tp10 -64.9 -58.64 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mmtt -65.79 -37.75 87.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.253 -0.904 . . . . 0.0 109.581 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' CA ' ' HB3' ' B' ' 6' ' ' ALA . . . -67.59 -18.45 64.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.617 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.459 ' CG ' HD13 ' A' ' 11' ' ' ILE . 14.4 ttp -82.6 -49.68 9.59 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.928 . . . . 0.0 109.561 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.95 -27.71 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB2' ' O ' ' B' ' 2' ' ' GLU . . . -78.29 -65.63 0.95 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.576 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.512 HD21 ' CZ ' ' A' ' 73' ' ' PHE . 19.9 mt -49.76 -46.13 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.585 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.459 HD13 ' CG ' ' A' ' 7' ' ' MET . 50.8 mt -58.88 -44.86 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.523 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 26.4 t0 -62.59 -21.42 65.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.592 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 2.8 t -85.25 -26.0 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.2 -0.938 . . . . 0.0 109.425 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 2.9 t80 -72.43 -52.08 17.49 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.974 -1.078 . . . . 0.0 109.285 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.457 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 0.3 OUTLIER -74.48 -30.31 61.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.885 . . . . 0.0 109.635 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 25.3 tt0 -72.4 -63.32 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 0.0 109.603 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.571 ' CG ' HD22 ' A' ' 35' ' ' LEU . 11.2 m-85 -56.44 -28.86 60.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.251 -0.905 . . . . 0.0 109.411 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.465 ' OG ' ' O ' ' A' ' 14' ' ' PHE . 60.8 p -77.59 -31.0 52.73 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.498 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.51 -22.56 63.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.52 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 17.3 mtp85 -69.04 -27.6 65.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -1.144 . . . . 0.0 109.453 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.521 ' CG ' ' N ' ' A' ' 22' ' ' GLY . 46.8 tt0 -97.91 165.74 11.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.252 -0.905 . . . . 0.0 109.393 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.521 ' N ' ' CG ' ' A' ' 21' ' ' GLU . . . -43.93 -63.01 2.42 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.01 -177.68 0.28 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.284 -1.127 . . . . 0.0 109.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 15' ' ' HIS . 28.8 mtmt -143.69 45.56 1.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.253 -0.905 . . . . 0.0 109.469 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.427 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t60 -164.91 25.7 0.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 109.455 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.488 ' HD2' ' CB ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -170.03 170.21 7.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.264 -0.898 . . . . 0.0 109.486 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 35' ' ' LEU . 9.7 mp -120.49 164.69 16.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -122.59 69.65 0.98 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.235 -0.916 . . . . 0.0 109.504 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 63.05 -83.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.618 -0.676 . . . . 0.0 110.686 179.441 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -46.68 -35.4 5.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.146 -0.971 . . . . 0.0 110.86 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.549 ' HB3' ' CG ' ' A' ' 27' ' ' LEU . 1.7 mp0 -62.64 -42.3 99.52 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 108.851 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 5.1 mt -57.6 -56.62 19.6 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.534 ' HG2' ' CG1' ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.5 -45.35 4.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.426 -0.796 . . . . 0.0 109.431 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.423 ' HG2' ' NH2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -63.86 -42.39 97.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.346 -0.846 . . . . 0.0 109.616 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.592 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 18.6 mt -48.18 -60.25 2.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.26 -0.9 . . . . 0.0 109.799 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.647 ' CD1' ' CE2' ' A' ' 76' ' ' PHE . 1.8 mp -75.55 -16.9 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.308 -0.87 . . . . 0.0 109.729 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.452 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 m-80 -93.62 1.09 56.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.188 -0.945 . . . . 0.0 109.709 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 34' ' ' GLU . 14.7 t30 -117.1 -25.39 7.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.138 -0.977 . . . . 0.0 109.295 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.521 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 68.8 mm-40 -126.58 -10.14 6.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.901 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.523 ' CB ' HG22 ' A' ' 36' ' ' ILE . 0.3 OUTLIER -120.08 56.61 0.96 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.042 -1.036 . . . . 0.0 109.489 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 63.7 p -112.97 11.23 19.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.301 -0.874 . . . . 0.0 109.385 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -104.27 -39.23 6.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 109.422 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.621 ' CE1' ' NE2' ' A' ' 85' ' ' HIS . 1.7 m-85 -88.49 -66.05 0.96 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.902 . . . . 0.0 109.46 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.59 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 0.3 OUTLIER -80.94 6.35 13.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.518 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' A' ' 41' ' ' SER . 3.5 mp0 51.14 -91.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.211 -0.931 . . . . 0.0 109.574 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 44' ' ' LEU . 22.6 pt-20 -135.83 177.39 7.87 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.438 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.51 ' CD1' HG22 ' A' ' 53' ' ' VAL . 8.2 mm -81.15 135.62 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.476 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.6 mttt -86.27 61.82 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.252 -0.905 . . . . 0.0 109.251 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.5 OUTLIER 83.29 -42.49 0.1 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 109.647 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.485 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 2.1 mt-30 167.43 57.95 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.093 -1.004 . . . . 0.0 109.341 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 2.0 tt0 -89.29 -70.34 0.66 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.157 -0.964 . . . . 0.0 109.587 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.529 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.1 t -90.54 -20.74 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.113 -0.992 . . . . 0.0 109.238 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.534 ' CG1' ' HG2' ' A' ' 33' ' ' LYS . 24.9 t -77.22 -29.11 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.156 -0.965 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.485 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 0.5 OUTLIER -90.12 -32.41 16.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.38 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 1.1 tmtp? -75.88 -37.76 58.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.407 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.533 ' HB ' ' CD1' ' A' ' 60' ' ' LEU . 8.8 m -56.35 -53.2 42.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.211 -0.93 . . . . 0.0 109.748 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.484 ' C ' ' O ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -40.16 -28.91 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.155 -0.966 . . . . 0.0 109.53 -179.713 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -75.03 -50.54 16.18 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' A' ' 60' ' ' LEU . 14.3 m -79.19 -64.8 1.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 108.794 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.637 ' CD2' ' CD2' ' A' ' 76' ' ' PHE . 4.2 mp -38.09 -47.82 1.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.708 -0.62 . . . . 0.0 109.756 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' HB2' ' O ' ' A' ' 57' ' ' MET . 0.5 OUTLIER -88.3 86.9 7.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.54 -7.64 7.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.513 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -78.27 -41.7 33.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.488 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.46 2.12 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -177.28 -35.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.244 -1.151 . . . . 0.0 108.593 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.35 -13.38 36.51 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.488 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 8.5 mt-10 -108.67 147.38 31.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -1.13 . . . . 0.0 109.515 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.52 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 1.9 t -69.79 147.74 50.04 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.307 -0.87 . . . . 0.0 109.601 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -116.63 170.98 8.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.513 -0.742 . . . . 0.0 109.359 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -61.45 -52.05 66.16 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.346 -0.847 . . . . 0.0 110.453 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -51.94 -39.32 59.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.327 -0.858 . . . . 0.0 109.548 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.52 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 1.6 pt-20 -79.6 -22.58 43.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.157 -0.965 . . . . 0.0 109.637 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.574 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 10.8 t80 -62.28 -59.53 4.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 109.003 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.528 ' HG2' ' CG ' ' B' ' 74' ' ' MET . 2.4 ttm -65.22 -44.8 87.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.314 -0.867 . . . . 0.0 109.1 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.524 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -60.24 -22.17 62.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.009 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.647 ' CE2' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.48 -63.59 1.09 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.815 . . . . 0.0 108.838 179.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.498 ' O ' ' CB ' ' A' ' 81' ' ' THR . 42.0 t -56.52 -23.1 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.543 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -63.48 -49.97 71.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.499 -0.751 . . . . 0.0 109.065 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 83' ' ' ALA . 39.1 mtp -72.77 -70.11 0.37 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.388 -0.82 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.558 HG23 ' CD1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.25 -25.84 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 120.575 -1.328 . . . . 0.0 110.02 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.514 ' CG2' HD12 ' B' ' 11' ' ' ILE . 4.6 m -77.67 -69.96 0.51 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.936 -1.102 . . . . 0.0 108.629 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -77.8 -49.91 13.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.093 -1.004 . . . . 0.0 108.325 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.581 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -39.25 -48.21 1.77 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.371 0.605 . . . . 0.0 109.453 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 44' ' ' LEU . 13.4 t -61.03 -46.3 91.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.317 -0.864 . . . . 0.0 109.403 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.621 ' NE2' ' CE1' ' A' ' 43' ' ' PHE . 3.4 m-70 -68.43 -11.19 59.34 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.456 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' A' ' 87' ' ' PHE . 4.8 tp10 -86.99 -37.26 17.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.4 ' C ' ' O ' ' A' ' 86' ' ' GLU . 49.2 t80 -44.98 -26.21 0.4 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 109.395 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -68.09 0.5 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.21 167.5 21.79 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.238 -0.914 . . . . 0.0 109.42 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -139.64 131.46 27.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.219 -0.926 . . . . 0.0 109.436 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.456 179.966 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.535 ' HB3' ' N ' ' B' ' 5' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 2.5 mp0 39.23 -93.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.577 -0.702 . . . . 0.0 110.249 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.521 ' HB2' ' CB ' ' A' ' 39' ' ' GLU . 20.5 mt -75.83 -50.41 15.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.932 . . . . 0.0 109.43 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.463 ' HB3' ' HB3' ' B' ' 1' ' ' SER . 0.9 OUTLIER -49.87 -34.54 20.43 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.176 -0.952 . . . . 0.0 109.023 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.535 ' N ' ' HB3' ' B' ' 1' ' ' SER . 0.5 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.256 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.503 ' HB3' ' CA ' ' A' ' 6' ' ' ALA . . . -66.15 -10.0 36.91 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 109.339 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' B' ' 11' ' ' ILE . 4.0 mtp -80.5 -57.71 3.46 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.267 -0.895 . . . . 0.0 109.392 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 16.5 t -64.23 -32.71 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.3 -0.875 . . . . 0.0 109.351 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 2' ' ' GLU . . . -70.19 -68.9 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.333 -0.854 . . . . 0.0 109.561 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.632 ' CD2' ' CZ ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -51.3 -60.39 3.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.255 -0.903 . . . . 0.0 109.493 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.514 HD12 ' CG2' ' A' ' 81' ' ' THR . 28.2 mt -42.86 -41.06 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -59.12 -47.92 83.49 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.364 -0.835 . . . . 0.0 109.659 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.615 ' CG1' ' CZ ' ' B' ' 73' ' ' PHE . 1.0 OUTLIER -61.23 -34.05 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.137 -0.977 . . . . 0.0 109.673 -179.616 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.576 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 9.1 t80 -60.11 -70.32 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.045 -1.034 . . . . 0.0 109.159 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -64.79 -9.82 23.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.723 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.473 ' HB3' ' HA ' ' B' ' 13' ' ' VAL . 56.7 tp60 -75.49 -69.93 0.45 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.834 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.636 ' CZ ' ' CD2' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -100.26 21.37 13.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.145 -0.972 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 2.5 t -80.86 -19.9 43.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 109.328 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.502 ' CA ' ' HA ' ' B' ' 24' ' ' LYS . . . -103.1 8.71 53.94 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.455 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 22.1 mmt180 -52.89 -54.28 36.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -1.177 . . . . 0.0 109.449 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' CE ' ' B' ' 28' ' ' LYS . 1.0 OUTLIER -127.91 103.55 7.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.57 -147.48 16.42 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.464 ' O ' ' HA2' ' B' ' 19' ' ' GLY . 0.2 OUTLIER -71.41 167.28 19.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.249 -1.147 . . . . 0.0 109.474 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.502 ' HA ' ' CA ' ' B' ' 19' ' ' GLY . 3.5 mttp -104.93 40.85 1.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.924 . . . . 0.0 109.496 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -134.17 11.39 3.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.226 -0.921 . . . . 0.0 109.437 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.5 OUTLIER -161.71 169.99 20.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.458 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.584 HD23 ' CZ ' ' B' ' 17' ' ' TYR . 59.1 mt -120.61 141.01 50.73 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.707 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.52 ' CE ' ' O ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -87.25 165.72 15.46 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.49 ' N ' ' HD3' ' B' ' 29' ' ' LYS . 6.8 mmtp -42.72 -31.86 0.52 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.267 -0.896 . . . . 0.0 109.011 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 30.6 p -73.5 -58.0 3.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.443 -0.786 . . . . 0.0 110.189 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.544 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 1.6 mp0 -45.61 -44.32 12.97 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.047 -1.033 . . . . 0.0 109.117 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.585 ' CD1' ' CE ' ' B' ' 57' ' ' MET . 24.7 mt -54.09 -62.74 1.46 Allowed 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.512 ' HG3' ' CG1' ' B' ' 53' ' ' VAL . 0.2 OUTLIER -47.26 -23.17 0.5 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.893 . . . . 0.0 110.072 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' B' ' 30' ' ' SER . 23.2 mm-40 -75.82 -70.28 0.44 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.976 -1.078 . . . . 0.0 109.99 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.636 ' CD2' ' CZ ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -42.98 -33.03 0.72 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.414 -0.804 . . . . 0.0 109.634 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.574 HG13 ' CZ ' ' B' ' 76' ' ' PHE . 14.5 mt -72.5 -45.24 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.152 -0.967 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.453 ' OD1' ' HG2' ' B' ' 46' ' ' GLU . 1.9 m-80 -72.6 -9.36 58.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.539 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.56 -51.21 7.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.913 . . . . 0.0 109.369 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.524 ' CG ' ' HB3' ' A' ' 3' ' ' LEU . 1.3 tt0 -102.67 -43.43 5.6 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.0 109.348 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.517 ' CD1' ' HB ' ' B' ' 80' ' ' VAL . 1.0 OUTLIER -86.63 58.75 5.24 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 109.484 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' B' ' 37' ' ' ASN . 6.8 p -116.95 36.5 4.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.439 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 -35.96 1.56 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.233 -0.917 . . . . 0.0 109.451 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.09 -28.95 8.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 109.497 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.515 ' CD1' ' HB3' ' B' ' 40' ' ' LEU . 8.2 mp -75.93 -15.64 60.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 0.0 109.492 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 46' ' ' GLU . 15.2 mt-10 50.63 59.94 4.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.516 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' B' ' 47' ' ' ILE . 2.9 mt-10 43.94 41.1 3.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.272 -0.893 . . . . 0.0 109.482 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.527 ' CD1' HG22 ' B' ' 53' ' ' VAL . 1.8 mm 48.25 95.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.242 -0.911 . . . . 0.0 109.293 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.507 ' CE ' ' CG ' ' B' ' 51' ' ' GLU . 9.8 pttt -43.26 -45.51 5.83 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.238 -0.914 . . . . 0.0 109.544 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.476 ' CG ' ' C ' ' B' ' 48' ' ' LYS . 7.1 mt-10 -154.83 -39.65 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.875 . . . . 0.0 109.301 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 167.72 58.97 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.319 -0.863 . . . . 0.0 109.383 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.507 ' CG ' ' CE ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -86.45 -70.29 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.34 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.522 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.4 t -87.78 -27.11 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.929 . . . . 0.0 109.047 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.527 HG22 ' CD1' ' B' ' 47' ' ' ILE . 54.5 t -68.18 -20.42 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.306 -0.871 . . . . 0.0 109.042 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 4.8 t0 -90.16 -51.37 5.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.354 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -58.06 -33.88 69.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.528 ' HB ' ' CD1' ' B' ' 60' ' ' LEU . 25.3 m -58.56 -50.82 77.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.168 -0.957 . . . . 0.0 109.519 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.585 ' CE ' ' CD1' ' B' ' 32' ' ' LEU . 0.8 OUTLIER -44.91 -26.25 0.39 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.923 -1.11 . . . . 0.0 109.373 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' B' ' 56' ' ' VAL . 9.8 mt-10 -74.9 -47.08 31.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.264 -0.897 . . . . 0.0 108.978 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.464 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 45.0 m -85.01 -63.47 1.32 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.274 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.59 HD23 ' CE1' ' B' ' 76' ' ' PHE . 10.7 mp -38.33 -32.99 0.08 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.608 -0.682 . . . . 0.0 109.902 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' HE1' ' B' ' 57' ' ' MET . 76.0 m-20 -90.15 112.35 23.81 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.182 -0.949 . . . . 0.0 109.553 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.495 ' ND2' ' OE2' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -124.95 -29.3 3.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.225 -0.922 . . . . 0.0 109.641 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -82.17 -12.18 58.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.225 -0.922 . . . . 0.0 109.612 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 70.08 85.92 0.14 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 12.9 t0 178.14 -32.32 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.321 -1.105 . . . . 0.0 108.678 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.449 ' HA2' ' HE2' ' B' ' 29' ' ' LYS . . . 110.36 38.22 1.67 Allowed Glycine 0 N--CA 1.485 1.938 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -135.42 119.52 17.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.337 -1.096 . . . . 0.0 109.335 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.473 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 16.4 t -69.73 156.96 38.2 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 0.0 109.854 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.473 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.5 OUTLIER -120.64 171.77 8.34 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -62.6 -50.94 69.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.353 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.463 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 2.8 pt20 -55.45 -40.18 71.25 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.139 -0.975 . . . . 0.0 108.944 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.495 ' OE2' ' ND2' ' B' ' 62' ' ' ASN . 0.8 OUTLIER -78.95 -17.9 54.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.314 -0.866 . . . . 0.0 109.184 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.632 ' CZ ' ' CD2' ' B' ' 10' ' ' LEU . 5.3 t80 -65.41 -57.34 8.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.543 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -64.01 -42.13 97.24 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.011 -1.056 . . . . 0.0 108.408 179.136 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.524 ' HB1' ' CB ' ' A' ' 75' ' ' ALA . . . -67.64 -16.34 64.11 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.335 -0.853 . . . . 0.0 108.798 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.59 ' CE1' HD23 ' B' ' 60' ' ' LEU . 2.1 t80 -71.8 -62.63 1.35 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.456 ' O ' ' OG1' ' B' ' 81' ' ' THR . 75.2 t -62.0 -26.77 40.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.525 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -60.77 -44.72 96.4 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.39 -0.819 . . . . 0.0 109.099 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 12.8 mtp -73.67 -69.88 0.41 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.276 -0.89 . . . . 0.0 109.155 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.522 ' CG1' HG13 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -41.86 -26.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.7 -1.25 . . . . 0.0 109.615 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.502 ' N ' ' O ' ' B' ' 79' ' ' MET . 12.5 m -75.64 -70.09 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.043 -1.036 . . . . 0.0 108.868 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.569 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.9 t -78.07 -49.45 13.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.121 -0.987 . . . . 0.0 108.574 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.569 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -38.31 -41.53 0.63 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.257 0.551 . . . . 0.0 109.856 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.94 -36.45 27.98 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 109.649 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.8 t-160 -67.96 -9.95 49.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.165 -0.959 . . . . 0.0 109.658 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.514 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 1.4 pp20? -80.64 -13.43 59.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 109.61 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -52.12 -20.86 2.77 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.168 -0.957 . . . . 0.0 109.545 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.12 -69.44 0.37 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 109.458 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' B' ' 90' ' ' HIS . 1.0 OUTLIER -113.95 -148.91 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.451 ' HB2' ' O ' ' B' ' 89' ' ' GLU . 0.5 OUTLIER 60.97 87.66 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.462 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.445 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.438 ' CB ' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.526 ' OE1' ' CB ' ' B' ' 9' ' ' ALA . 0.2 OUTLIER -63.9 -71.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.523 ' CB ' ' CG ' ' B' ' 39' ' ' GLU . 0.9 OUTLIER -68.72 -24.54 64.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.538 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.438 ' HB2' ' CB ' ' A' ' 1' ' ' SER . 0.2 OUTLIER -59.67 -52.8 63.94 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.457 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -65.86 -48.89 70.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.517 ' CB ' ' HB2' ' B' ' 6' ' ' ALA . . . -60.81 -17.47 49.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.9 ttp -77.68 -61.43 1.99 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.197 -0.939 . . . . 0.0 109.54 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.473 HG11 ' N ' ' A' ' 9' ' ' ALA . 9.8 p -49.69 -34.2 8.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.258 -0.902 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.473 ' N ' HG11 ' A' ' 8' ' ' VAL . . . -66.42 -66.4 0.56 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.506 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.421 ' HG ' HD23 ' B' ' 3' ' ' LEU . 0.3 OUTLIER -45.42 -25.73 0.46 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.451 HD12 ' CZ ' ' A' ' 70' ' ' PHE . 17.7 mm -68.93 -53.85 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.267 -0.896 . . . . 0.0 109.498 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.53 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 7.4 t0 -61.48 -18.73 60.35 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.31 -0.869 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.58 HG12 ' CD1' ' A' ' 17' ' ' TYR . 2.1 t -87.67 -28.84 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.254 -0.904 . . . . 0.0 109.374 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 5.1 t80 -70.05 -46.53 64.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.018 -1.051 . . . . 0.0 109.339 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -80.5 -34.53 35.67 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.329 -0.857 . . . . 0.0 109.711 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.1 tt0 -65.17 -57.74 7.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.2 -0.938 . . . . 0.0 109.606 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.58 ' CD1' HG12 ' A' ' 13' ' ' VAL . 50.6 m-85 -65.45 -33.51 76.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.899 . . . . 0.0 109.569 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.515 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 59.9 p -82.23 0.96 38.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.216 -0.927 . . . . 0.0 109.698 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.94 -22.86 75.95 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 5.2 mtt-85 -77.03 -15.47 59.6 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.261 -1.141 . . . . 0.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -93.52 168.2 11.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 109.439 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.73 -38.1 57.07 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 1.8 m-20 -62.47 -34.92 77.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.126 . . . . 0.0 109.439 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 16.6 mtpt 74.97 0.82 3.64 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.579 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.2 m170 -138.11 7.42 2.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.0 109.573 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.527 ' CD ' ' O ' ' A' ' 68' ' ' CYS . 1.0 OUTLIER -137.83 142.98 40.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.205 -0.934 . . . . 0.0 109.437 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.54 ' CD2' ' HB3' ' A' ' 31' ' ' GLU . 6.7 mp -86.85 161.15 18.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.171 -0.956 . . . . 0.0 109.51 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.52 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -126.59 73.73 1.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.291 -0.881 . . . . 0.0 109.279 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 2.6 tttm 63.71 -84.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.607 -0.683 . . . . 0.0 110.267 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 m -44.69 -48.24 10.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.168 -0.957 . . . . 0.0 110.535 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.54 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -56.62 -39.86 74.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.926 -1.109 . . . . 0.0 109.358 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.553 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 25.0 mt -60.88 -65.81 0.63 Allowed 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.542 -0.724 . . . . 0.0 109.208 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HG2' ' CD1' ' A' ' 47' ' ' ILE . 3.7 ttpt -42.74 -27.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.346 -0.846 . . . . 0.0 109.527 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -67.22 -63.98 0.95 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.211 -0.931 . . . . 0.0 109.353 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.573 HD11 ' CD2' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -44.32 -32.91 1.45 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.879 . . . . 0.0 109.528 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 53' ' ' VAL . 1.5 mp -70.13 -49.89 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.937 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.442 ' OD1' HD13 ' A' ' 47' ' ' ILE . 2.7 m-20 -86.96 11.91 12.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 109.659 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.417 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -109.46 -40.96 4.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.163 -0.961 . . . . 0.0 109.517 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.522 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 0.0 OUTLIER -121.61 -22.53 5.84 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.631 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.522 ' CD1' ' HB ' ' A' ' 80' ' ' VAL . 16.9 mt -97.18 33.4 1.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.144 -0.973 . . . . 0.0 109.438 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t -88.7 -8.56 54.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.457 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -87.25 -66.16 0.94 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.917 . . . . 0.0 109.506 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.617 ' CE1' ' NE2' ' A' ' 85' ' ' HIS . 2.4 m-85 -59.5 -93.45 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.245 -0.91 . . . . 0.0 109.434 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.524 ' O ' ' CG ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -49.02 -43.16 40.26 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.161 -0.962 . . . . 0.0 109.318 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.524 ' CG ' ' O ' ' A' ' 44' ' ' LEU . 9.0 pt-20 41.54 27.86 0.07 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.431 -0.793 . . . . 0.0 109.763 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 2.3 tp10 176.7 101.05 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.195 -0.941 . . . . 0.0 109.427 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.527 ' CG2' HG22 ' A' ' 53' ' ' VAL . 33.0 mt -60.94 -18.46 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.213 -0.929 . . . . 0.0 109.529 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.2 mtmt 75.16 26.28 1.24 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.277 -0.89 . . . . 0.0 109.322 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 tt0 83.33 -43.38 0.1 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.693 -0.629 . . . . 0.0 109.802 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.418 ' CD ' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -178.15 54.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.075 -1.015 . . . . 0.0 109.499 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HB2' ' HB2' ' A' ' 48' ' ' LYS . 50.2 tp10 -90.03 -70.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.487 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.529 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 1.7 t -90.97 -16.12 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.173 -0.954 . . . . 0.0 109.316 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.527 HG22 ' CG2' ' A' ' 47' ' ' ILE . 41.2 t -80.76 -24.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.0 108.96 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.82 -33.07 21.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 109.119 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -41.97 26.83 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.35 -0.844 . . . . 0.0 109.293 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.526 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 28.6 m -58.81 -49.24 83.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 O-C-N 121.251 -0.906 . . . . 0.0 109.493 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.553 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 4.3 tpt -42.97 -27.01 0.16 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.505 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 56' ' ' VAL . 2.0 tm-20 -79.04 -45.68 19.67 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.266 -0.897 . . . . 0.0 109.114 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 60' ' ' LEU . 22.3 m -79.03 -63.48 1.41 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 109.505 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.525 ' CG ' ' HB2' ' A' ' 76' ' ' PHE . 7.6 mp -37.92 -43.85 0.73 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.613 -0.679 . . . . 0.0 109.955 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.491 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 8.0 m-20 -90.11 69.99 7.29 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.159 -0.963 . . . . 0.0 109.453 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -95.69 -9.4 32.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' O ' ' A' ' 67' ' ' GLU . 2.7 p-10 -78.86 -13.45 59.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.182 -0.948 . . . . 0.0 109.503 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 65.26 83.86 0.09 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 13.5 t0 177.63 -32.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.206 -1.173 . . . . 0.0 108.658 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.24 36.57 1.94 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' OD1' ' A' ' 63' ' ' ASP . 39.5 mt-10 -148.94 124.18 10.19 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.299 -1.118 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.527 ' O ' ' CD ' ' A' ' 26' ' ' LYS . 14.0 t -69.9 155.23 40.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.199 -0.938 . . . . 0.0 109.659 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.463 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -115.47 171.27 7.82 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 179.679 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.523 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -60.77 -49.73 76.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 110.149 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' B' ' 79' ' ' MET . 50.4 mt-30 -54.72 -43.42 72.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 108.997 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.463 ' HG3' ' HB2' ' A' ' 69' ' ' ASP . 1.4 mt-10 -76.78 -16.95 59.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.392 -0.818 . . . . 0.0 109.649 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.567 ' CE2' HG11 ' A' ' 13' ' ' VAL . 13.7 t80 -71.08 -52.92 16.67 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.049 -1.032 . . . . 0.0 109.161 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.527 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.6 OUTLIER -65.14 -42.23 94.03 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.162 -0.961 . . . . 0.0 108.785 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.48 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -66.7 -25.17 66.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 108.734 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.579 ' CE1' HG22 ' A' ' 80' ' ' VAL . 0.2 OUTLIER -64.21 -63.0 1.26 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.518 ' CG1' ' CE ' ' B' ' 7' ' ' MET . 96.9 t -62.59 -25.4 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.313 -0.867 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.532 ' HB1' ' CB ' ' B' ' 74' ' ' MET . . . -68.85 -29.08 67.33 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.455 -0.778 . . . . 0.0 109.065 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.594 ' O ' ' N ' ' A' ' 83' ' ' ALA . 19.5 mtp -84.59 -70.88 0.55 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.31 -0.869 . . . . 0.0 109.188 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.579 HG22 ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -44.9 -25.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 O-C-N 120.416 -1.428 . . . . 0.0 109.458 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.512 ' CG2' ' SD ' ' B' ' 7' ' ' MET . 41.7 m -81.75 -63.71 1.33 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 108.499 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.567 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 2.0 m -79.91 -54.6 5.66 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.594 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -36.51 -43.7 0.41 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.321 0.581 . . . . 0.0 109.753 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -71.14 -45.16 64.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.405 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.617 ' NE2' ' CE1' ' A' ' 43' ' ' PHE . 1.9 m-70 -62.43 -13.64 32.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.234 -0.916 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.88 -48.09 17.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.411 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -59.09 -26.82 64.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.23 -0.919 . . . . 0.0 109.416 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.77 -38.56 56.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 0.0 109.439 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.53 -68.51 0.47 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.202 -0.937 . . . . 0.0 109.446 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.403 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 15.2 t-80 53.17 44.6 30.06 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.233 -0.917 . . . . 0.0 109.457 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.479 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.418 ' N ' ' HB3' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' B' ' 2' ' ' GLU . 1.1 tp10 -64.76 -76.46 0.07 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.249 -0.907 . . . . 0.0 109.444 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.522 ' HB2' ' CB ' ' A' ' 39' ' ' GLU . 12.1 mt -69.73 -21.4 63.46 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -0.936 . . . . 0.0 109.438 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.418 ' HB3' ' N ' ' B' ' 1' ' ' SER . 2.9 tt0 -63.92 -51.7 63.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 109.396 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -43.02 71.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.894 . . . . 0.0 109.4 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.517 ' HB2' ' CB ' ' A' ' 6' ' ' ALA . . . -71.7 -12.3 61.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.525 ' HE2' ' CE ' ' B' ' 74' ' ' MET . 16.7 tpp -83.71 -45.17 13.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 53.2 t -68.63 -34.15 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . . . -72.07 -58.48 3.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.513 ' CD1' ' HB2' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -51.95 -55.24 21.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.262 -0.899 . . . . 0.0 109.476 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.453 HG13 ' SD ' ' B' ' 7' ' ' MET . 21.1 mt -47.85 -46.48 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.875 . . . . 0.0 109.5 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' B' ' 16' ' ' GLN . 5.0 t0 -56.63 -42.78 79.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.886 . . . . 0.0 109.549 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.591 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 2.2 t -64.27 -25.51 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.243 -0.911 . . . . 0.0 109.572 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.575 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 31.1 t80 -72.05 -40.26 68.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.938 -1.101 . . . . 0.0 109.596 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.575 ' CE1' ' HG2' ' B' ' 24' ' ' LYS . 18.1 t60 -74.03 -38.2 64.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.915 . . . . 0.0 110.271 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -74.67 -59.62 2.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.68 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.566 ' CD1' HG12 ' B' ' 13' ' ' VAL . 15.6 m-85 -55.01 -31.89 61.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.323 -0.86 . . . . 0.0 109.496 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 37.5 p -86.6 -22.02 26.47 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.201 -0.937 . . . . 0.0 109.51 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.468 ' CA ' ' HG3' ' B' ' 24' ' ' LYS . . . -83.56 -13.59 75.55 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 37.6 mtp85 -64.17 -61.88 1.97 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -1.19 . . . . 0.0 109.46 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -133.77 124.98 27.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.66 -108.31 0.82 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -150.8 27.6 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -1.113 . . . . 0.0 109.479 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.575 ' HG2' ' CE1' ' B' ' 15' ' ' HIS . 0.0 OUTLIER 53.82 61.1 3.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 109.464 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.575 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 2.2 m170 -170.14 -35.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.585 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.579 ' CB ' ' CB ' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -129.19 170.35 13.67 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.56 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.553 ' CD1' ' CD1' ' B' ' 35' ' ' LEU . 70.1 mt -119.09 136.97 53.88 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.218 -0.926 . . . . 0.0 110.022 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -86.6 165.96 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.514 ' CG ' ' SD ' ' B' ' 57' ' ' MET . 0.1 OUTLIER -42.84 -26.94 0.15 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.982 . . . . 0.0 109.87 -179.708 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -78.65 -49.38 13.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.208 -0.932 . . . . 0.0 110.411 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.544 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 37.1 mm-40 -55.98 -41.85 75.43 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.982 -1.074 . . . . 0.0 108.663 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.588 ' CD2' ' CD1' ' B' ' 60' ' ' LEU . 2.1 mt -57.61 -65.98 0.54 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.792 -0.568 . . . . 0.0 109.615 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.511 ' CG ' HG12 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.34 -30.96 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.367 -0.833 . . . . 0.0 109.648 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -67.91 0.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.923 . . . . 0.0 109.301 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.591 ' CD2' ' CG1' ' B' ' 13' ' ' VAL . 12.1 mt -45.72 -25.46 0.49 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 109.547 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.582 HD13 ' CZ ' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -70.84 -59.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 108.91 179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' B' ' 42' ' ' HIS . 51.2 m-80 -78.89 4.83 13.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 109.708 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.07 -11.11 9.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.399 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.523 ' CG ' ' CB ' ' A' ' 3' ' ' LEU . 5.4 tm-20 -101.94 -40.74 6.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 0.0 109.4 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.535 ' O ' ' CB ' ' B' ' 41' ' ' SER . 2.7 mm? -88.22 -46.72 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.255 -0.903 . . . . 0.0 109.393 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.0 t 162.31 -89.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.382 -0.824 . . . . 0.0 109.261 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.491 ' HB3' ' CD2' ' B' ' 43' ' ' PHE . 3.4 m170 -125.02 -47.74 1.77 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.309 -0.869 . . . . 0.0 109.252 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.491 ' CD2' ' HB3' ' B' ' 42' ' ' HIS . 3.9 p90 -151.28 18.34 0.74 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.346 -0.846 . . . . 0.0 109.325 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' B' ' 44' ' ' LEU . 0.1 OUTLIER 34.48 39.54 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.859 -0.526 . . . . 0.0 110.275 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' B' ' 46' ' ' GLU . 0.2 OUTLIER 42.99 59.65 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.217 -0.927 . . . . 0.0 109.483 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 6.1 tt0 174.84 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.324 -0.86 . . . . 0.0 109.3 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.561 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 14.0 mm -47.47 -90.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.188 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 6.2 mtmt 83.37 -60.12 0.13 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.639 -0.663 . . . . 0.0 109.973 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.426 ' HG3' ' HG2' ' B' ' 50' ' ' GLN . 5.4 pt-20 -143.88 -46.55 0.27 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.057 -1.027 . . . . 0.0 109.637 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -164.93 31.05 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.955 . . . . 0.0 109.721 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.15 -70.4 0.24 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -1.0 . . . . 0.0 109.082 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.53 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 2.1 t -84.11 -9.61 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.0 109.037 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.531 ' CG2' HD11 ' B' ' 47' ' ' ILE . 2.2 t -82.5 -31.61 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.065 -1.022 . . . . 0.0 109.099 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 1.4 t70 -90.33 -29.57 18.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.411 -0.806 . . . . 0.0 109.191 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -84.39 -44.64 13.54 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.332 -0.855 . . . . 0.0 109.398 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.53 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 0.8 OUTLIER -68.2 -42.84 85.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 O-C-N 121.125 -0.984 . . . . 0.0 109.314 179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.519 ' CE ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.88 -55.0 2.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 110.318 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -58.44 -40.65 83.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.954 . . . . 0.0 109.323 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.525 ' CG2' ' SD ' ' B' ' 79' ' ' MET . 99.4 m -67.61 -20.2 65.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 110.356 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.588 ' CD1' ' CD2' ' B' ' 32' ' ' LEU . 0.3 OUTLIER -82.2 -72.48 0.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.932 -1.105 . . . . 0.0 109.151 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.26 100.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 0.0 109.496 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.92 9.08 4.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.275 -0.891 . . . . 0.0 109.545 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.91 -29.78 9.27 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.936 . . . . 0.0 109.405 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.76 2.13 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -175.26 -36.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.257 -1.143 . . . . 0.0 108.521 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 -12.9 50.68 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.579 ' CB ' ' CB ' ' B' ' 26' ' ' LYS . 1.7 mm-40 -112.24 150.54 30.77 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.257 -1.143 . . . . 0.0 109.457 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.532 ' SG ' ' CD2' ' B' ' 32' ' ' LEU . 7.2 m -73.74 155.77 38.58 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.203 -0.936 . . . . 0.0 110.199 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.41 171.5 7.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.481 -0.762 . . . . 0.0 109.196 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.567 ' CG ' ' OG1' ' A' ' 82' ' ' THR . 0.2 OUTLIER -57.88 -53.63 56.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.238 -0.914 . . . . 0.0 110.672 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' B' ' 72' ' ' GLU . 1.9 pt20 -62.31 -29.99 70.83 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.23 -0.919 . . . . 0.0 108.687 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.481 ' N ' ' HG3' ' B' ' 71' ' ' GLN . 1.1 tt0 -81.78 -15.25 54.86 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.563 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 5.7 t80 -75.35 -52.3 11.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.185 -0.947 . . . . 0.0 108.938 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.532 ' CB ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -66.64 -45.82 77.78 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.891 . . . . 0.0 109.188 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.525 ' O ' ' CE ' ' B' ' 79' ' ' MET . . . -59.09 -43.41 91.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 108.922 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.582 ' CZ ' HD13 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -49.15 -60.11 3.08 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.525 HG13 ' CE ' ' A' ' 74' ' ' MET . 44.0 t -59.92 -25.57 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.342 -0.848 . . . . 0.0 108.714 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.527 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -60.86 -37.31 81.69 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.52 -0.737 . . . . 0.0 109.207 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 1.1 mtm -79.11 -66.79 0.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.577 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -47.95 -22.43 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 O-C-N 120.473 -1.392 . . . . 0.0 109.218 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 16.3 m -78.42 -66.44 0.85 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.059 -1.026 . . . . 0.0 108.915 178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.8 t -81.37 -49.84 10.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.995 . . . . 0.0 108.756 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.568 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.85 -35.92 0.17 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.807 -0.558 . . . . 0.0 109.605 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' B' ' 44' ' ' LEU . 10.0 t -67.07 -52.89 36.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.367 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.49 -10.4 51.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.225 -0.922 . . . . 0.0 109.543 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -90.14 -34.56 15.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.193 -0.942 . . . . 0.0 109.493 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.65 -33.07 70.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.901 . . . . 0.0 109.483 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -47.49 -65.99 0.48 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.241 -0.912 . . . . 0.0 109.493 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.52 174.74 13.61 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.247 -0.908 . . . . 0.0 109.464 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.438 ' O ' ' O ' ' B' ' 91' ' ' GLU . 0.4 OUTLIER 61.6 95.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.255 -0.903 . . . . 0.0 109.504 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . 0.438 ' O ' ' O ' ' B' ' 90' ' ' HIS . 39.2 mt-10 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.497 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.416 ' OG ' ' OE1' ' B' ' 39' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.526 ' CG ' HG22 ' B' ' 13' ' ' VAL . 1.3 mp0 -73.96 -71.24 0.34 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.299 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 3.4 mp -61.48 -18.02 57.15 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.342 -0.849 . . . . 0.0 109.404 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.456 ' O ' ' CG ' ' A' ' 7' ' ' MET . 5.2 tt0 -68.89 -66.98 0.51 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.074 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.48 ' HA ' ' CG2' ' A' ' 8' ' ' VAL . 2.5 ttmt -65.49 -14.59 61.33 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.278 -0.889 . . . . 0.0 109.055 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.526 ' O ' ' CD1' ' A' ' 10' ' ' LEU . . . -82.81 -29.4 29.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.332 -0.855 . . . . 0.0 109.117 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 8' ' ' VAL . 3.7 ptp -83.33 -23.77 32.39 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 109.251 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.5 HG22 ' N ' ' A' ' 9' ' ' ALA . 32.9 m -80.39 -44.33 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.261 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.5 ' N ' HG22 ' A' ' 8' ' ' VAL . . . -71.23 -36.38 71.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.456 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.574 HD22 ' CZ ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -75.15 -54.18 7.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 109.626 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.517 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -46.62 -45.86 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.098 -1.001 . . . . 0.0 109.352 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.517 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -67.8 -34.17 76.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.192 -0.942 . . . . 0.0 109.583 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.527 HG13 ' CD2' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -73.97 -15.42 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.2 t80 -85.78 -41.88 14.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.01 -1.056 . . . . 0.0 109.281 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.462 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 10.6 m170 -74.47 -28.91 61.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.284 -0.885 . . . . 0.0 109.352 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -79.74 -60.29 2.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.911 . . . . 0.0 109.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.565 ' CG ' ' HG ' ' A' ' 35' ' ' LEU . 37.9 m-85 -59.0 -46.09 89.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.497 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 14' ' ' PHE . 1.5 p -75.05 -11.94 60.21 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 109.481 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.518 ' HA3' ' CG ' ' A' ' 24' ' ' LYS . . . -94.99 26.62 18.0 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -90.06 -16.83 28.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -1.151 . . . . 0.0 109.569 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 23' ' ' ASP . 27.2 mt-10 -105.44 69.35 0.83 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.146 -0.971 . . . . 0.0 109.683 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.446 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . 39.58 28.43 0.12 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' N ' ' O ' ' A' ' 21' ' ' GLU . 11.9 t70 -179.47 137.26 0.13 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.098 -1.236 . . . . 0.0 109.662 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.518 ' CG ' ' HA3' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -108.83 112.94 25.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.304 -0.872 . . . . 0.0 109.383 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.427 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 3.0 t-80 -170.07 -35.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.642 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -145.06 170.2 16.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.561 ' CD2' ' HB3' ' A' ' 31' ' ' GLU . 1.7 mp -117.79 128.0 54.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.236 -0.915 . . . . 0.0 110.032 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.559 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -74.26 161.39 29.97 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.005 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.559 ' N ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -28.93 0.24 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.873 -1.142 . . . . 0.0 109.488 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 28' ' ' LYS . 3.0 m -82.29 -40.73 21.11 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.376 -0.827 . . . . 0.0 110.164 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.561 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -58.64 -40.35 83.17 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.794 -1.191 . . . . 0.0 108.483 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.626 ' CD2' ' CE2' ' A' ' 76' ' ' PHE . 17.8 mt -62.94 -61.83 2.13 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HD2' ' ND2' ' A' ' 37' ' ' ASN . 0.1 OUTLIER -42.31 -27.22 0.14 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 109.757 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.28 -67.33 0.76 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.661 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -42.02 -30.73 0.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.424 -0.797 . . . . 0.0 110.086 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.52 ' CG2' HG13 ' A' ' 80' ' ' VAL . 6.0 mm -85.38 -41.86 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.187 -0.945 . . . . 0.0 109.421 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.49 ' ND2' ' HD2' ' A' ' 33' ' ' LYS . 2.2 m-80 -87.51 11.6 14.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.551 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.459 ' HB3' ' OH ' ' A' ' 17' ' ' TYR . 2.0 m-80 -118.09 -44.72 2.68 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.448 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.467 ' HB3' ' HB2' ' B' ' 3' ' ' LEU . 13.8 mm-40 -109.32 -9.89 14.96 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.278 -0.889 . . . . 0.0 109.49 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.484 ' CG ' HD22 ' A' ' 44' ' ' LEU . 5.6 mp -119.63 41.78 3.05 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 109.471 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 45' ' ' GLU . 35.3 p -122.42 12.05 10.06 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.495 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -105.5 -60.34 1.64 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.211 -0.93 . . . . 0.0 109.426 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -89.74 0.07 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.0 109.498 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 46' ' ' GLU . 2.0 pp -49.57 -28.7 5.92 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.232 -0.918 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.467 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 13.9 mt-10 43.21 -96.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.348 -0.845 . . . . 0.0 109.47 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.519 ' OE1' ' CG2' ' A' ' 52' ' ' VAL . 0.3 OUTLIER 42.15 -157.86 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.233 -0.917 . . . . 0.0 109.556 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.537 HG22 ' CG2' ' A' ' 53' ' ' VAL . 8.6 mt 56.29 163.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.227 -0.921 . . . . 0.0 109.394 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.517 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 6.4 ptmt 163.23 -34.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.286 -0.883 . . . . 0.0 109.384 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.46 ' HG3' ' HG3' ' A' ' 50' ' ' GLN . 25.3 pt-20 -140.43 -38.44 0.44 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.87 . . . . 0.0 109.412 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG3' ' HG3' ' A' ' 49' ' ' GLU . 2.2 pt20 167.72 48.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.202 -0.936 . . . . 0.0 109.612 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.67 -70.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.178 -0.951 . . . . 0.0 109.281 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.536 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 2.3 t -91.63 -12.96 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.0 108.878 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.537 ' CG2' HG22 ' A' ' 47' ' ' ILE . 35.8 t -82.58 -27.51 8.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.14 -0.975 . . . . 0.0 108.84 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -90.46 -34.37 15.62 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.475 -0.766 . . . . 0.0 109.106 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -45.15 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.342 -0.849 . . . . 0.0 109.407 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.527 HG21 ' CD2' ' A' ' 60' ' ' LEU . 1.3 p -64.9 -44.04 96.24 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.064 -1.023 . . . . 0.0 109.303 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -41.01 -47.58 3.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.584 -0.698 . . . . 0.0 109.922 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.06 -44.61 97.12 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.185 -0.947 . . . . 0.0 108.848 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.7 m -73.24 -8.95 58.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.444 -0.785 . . . . 0.0 109.608 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.593 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . 2.9 mt -85.66 -74.69 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.145 -0.972 . . . . 0.0 109.388 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.71 93.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.61 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.26 13.32 34.7 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.261 -0.899 . . . . 0.0 109.412 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.02 -45.34 2.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.0 109.541 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.07 91.16 2.15 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.62 -36.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.301 -1.117 . . . . 0.0 108.492 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 39.81 2.12 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -156.38 113.39 3.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -1.157 . . . . 0.0 109.331 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 94.9 m -69.8 157.77 36.73 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.215 -0.928 . . . . 0.0 110.076 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.424 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -118.42 170.6 8.79 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.323 -0.861 . . . . 0.0 109.093 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.433 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.1 OUTLIER -50.56 -64.76 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.366 -0.834 . . . . 0.0 111.293 -179.216 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 5.4 pt20 -45.28 -27.95 0.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.039 -1.038 . . . . 0.0 108.732 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.604 ' O ' ' CD1' ' A' ' 76' ' ' PHE . 3.3 mt-10 -77.58 -41.8 37.51 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.501 -0.75 . . . . 0.0 110.009 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.593 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 2.6 t80 -51.51 -50.41 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.81 -1.182 . . . . 0.0 109.016 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.536 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 9.6 mtp -62.81 -38.7 91.75 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.5 -0.75 . . . . 0.0 109.347 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.441 ' HB3' ' HB1' ' B' ' 75' ' ' ALA . . . -69.6 -16.67 63.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.172 -0.955 . . . . 0.0 108.787 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.626 ' CE2' ' CD2' ' A' ' 32' ' ' LEU . 15.0 m-30 -75.14 -70.05 0.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.52 HG22 ' CD2' ' B' ' 3' ' ' LEU . 99.2 t -52.1 -29.97 12.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.056 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.521 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -62.93 -44.45 96.05 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.679 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.8 OUTLIER -76.3 -69.64 0.49 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 109.968 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.536 ' CG1' ' HB ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -44.85 -23.38 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 O-C-N 120.575 -1.328 . . . . 0.0 109.717 -178.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.51 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 15.7 m -80.4 -67.81 0.74 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.893 -1.129 . . . . 0.0 108.927 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.1 t -77.32 -49.72 14.37 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.95 . . . . 0.0 108.768 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.563 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -37.87 -30.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.408 0.623 . . . . 0.0 109.557 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.474 ' N ' ' O ' ' A' ' 82' ' ' THR . 42.9 t -89.66 -41.66 11.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.312 -0.868 . . . . 0.0 109.448 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.411 ' N ' ' O ' ' A' ' 82' ' ' THR . 36.1 t60 -63.19 -11.92 24.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.633 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' A' ' 86' ' ' GLU . 6.2 tp10 -82.06 -35.65 28.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.94 . . . . 0.0 109.442 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -26.79 49.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.3 -0.875 . . . . 0.0 109.492 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -69.59 -23.23 63.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.275 -0.891 . . . . 0.0 109.505 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -128.72 91.71 3.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.483 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -86.38 144.88 27.11 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.251 -0.905 . . . . 0.0 109.46 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.468 179.987 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.436 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.491 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 5.2 mm-40 -64.82 -54.87 24.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.276 -0.89 . . . . 0.0 109.301 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' B' ' 3' ' ' LEU . 6.0 mp -70.98 -19.72 62.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.308 -0.87 . . . . 0.0 109.402 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.436 ' HB2' ' N ' ' B' ' 1' ' ' SER . 15.2 tp10 -63.05 -56.02 20.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.229 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.458 ' HD3' ' HD2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -64.69 -39.2 93.26 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.261 -0.899 . . . . 0.0 108.758 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.523 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -69.73 -16.12 63.27 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.299 -0.876 . . . . 0.0 109.106 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.503 ' HE3' ' CG2' ' A' ' 81' ' ' THR . 6.5 tpt -77.23 -50.55 12.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.417 -0.802 . . . . 0.0 109.26 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.437 ' O ' HG21 ' B' ' 11' ' ' ILE . 12.2 p -65.29 -31.03 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.234 -0.916 . . . . 0.0 109.476 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' B' ' 10' ' ' LEU . . . -79.88 -69.76 0.56 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.932 . . . . 0.0 109.564 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.496 HD21 ' CD1' ' A' ' 3' ' ' LEU . 36.7 mt -43.91 -45.74 7.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 109.59 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.543 ' CG2' ' N ' ' B' ' 12' ' ' ASP . 0.5 OUTLIER -61.08 -46.66 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.204 -0.935 . . . . 0.0 109.449 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.543 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 40.5 t0 -65.68 -15.2 62.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.276 -0.89 . . . . 0.0 109.475 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.586 HG11 ' CD1' ' B' ' 17' ' ' TYR . 2.2 t -89.7 -31.45 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 0.0 109.269 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.572 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 8.1 t80 -69.28 -46.13 67.95 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.995 -1.066 . . . . 0.0 109.123 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -78.14 -39.61 40.59 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.4 tt0 -62.92 -63.33 1.24 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 109.457 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.619 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 28.5 m-85 -53.7 -41.12 66.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.259 -0.9 . . . . 0.0 109.541 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.513 ' HB3' ' N ' ' B' ' 25' ' ' HIS . 1.7 m -61.51 -32.68 72.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.215 -0.928 . . . . 0.0 109.665 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.55 31.12 5.97 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.492 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 27.6 mmm180 -90.08 -30.84 17.44 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.15 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.6 mt-10 -153.71 93.99 1.73 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 109.525 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 57.99 158.16 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' C ' ' CG ' ' B' ' 24' ' ' LYS . 10.7 m-20 60.3 155.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.495 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.444 ' CG ' ' C ' ' B' ' 23' ' ' ASP . 0.9 OUTLIER -154.41 63.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.572 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -170.03 -35.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -118.98 167.27 11.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.0 109.588 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.534 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 79.6 mt -118.07 121.2 39.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.803 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.52 ' O ' ' CD1' ' B' ' 32' ' ' LEU . 0.2 OUTLIER -73.08 168.13 19.7 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.179 -0.951 . . . . 0.0 108.655 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -43.34 -26.95 0.22 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.16 -0.962 . . . . 0.0 109.537 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.423 ' N ' ' O ' ' B' ' 28' ' ' LYS . 31.2 m -74.5 -62.41 1.53 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.288 -0.883 . . . . 0.0 109.975 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.534 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 48.2 mm-40 -45.72 -42.47 11.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.092 -1.005 . . . . 0.0 109.223 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.527 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 4.3 mp -55.29 -69.44 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.601 -0.687 . . . . 0.0 109.264 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.528 ' HD3' ' CG1' ' B' ' 53' ' ' VAL . 4.5 mmtp -38.95 -32.47 0.09 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.465 -0.772 . . . . 0.0 109.744 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' B' ' 38' ' ' ASN . 0.3 OUTLIER -65.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.307 -0.87 . . . . 0.0 109.237 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.619 ' CD2' ' CD2' ' B' ' 17' ' ' TYR . 3.9 mm? -44.43 -26.15 0.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.299 -0.875 . . . . 0.0 109.464 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.534 ' CD1' ' CZ ' ' B' ' 76' ' ' PHE . 1.1 mm -75.01 -61.97 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.463 ' OD1' ' HA ' ' B' ' 46' ' ' GLU . 24.5 m-80 -87.91 18.75 3.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.706 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 23.4 t-20 -114.54 -44.91 3.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -0.909 . . . . 0.0 109.261 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.524 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 18.3 mm-40 -123.46 -9.99 7.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.332 -0.855 . . . . 0.0 109.451 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.515 ' HB3' ' CD1' ' B' ' 44' ' ' LEU . 18.4 mt -109.06 52.86 0.7 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.442 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.0 m -99.05 3.79 46.91 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.569 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.75 -81.63 0.14 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.923 . . . . 0.0 109.398 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -65.02 -74.32 0.11 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.463 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.515 ' CD1' ' HB3' ' B' ' 40' ' ' LEU . 0.3 OUTLIER -69.03 97.57 0.88 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.466 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.423 ' O ' ' O ' ' B' ' 44' ' ' LEU . 0.0 OUTLIER -43.89 -90.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.281 -0.887 . . . . 0.0 109.499 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.463 ' HA ' ' OD1' ' B' ' 37' ' ' ASN . 0.7 OUTLIER -126.02 52.63 1.67 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 109.436 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.52 ' CD1' HG23 ' B' ' 53' ' ' VAL . 42.8 mt 61.48 135.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.427 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.525 ' HB2' ' CG ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -86.26 61.37 6.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.224 -0.923 . . . . 0.0 109.393 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' B' ' 50' ' ' GLN . 0.5 OUTLIER 64.13 59.24 1.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.288 -0.883 . . . . 0.0 109.307 -179.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 4.2 mt-30 65.33 48.93 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.324 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.525 ' CG ' ' HB2' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -88.8 -70.15 0.66 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.211 -0.931 . . . . 0.0 109.568 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.52 HG13 ' CG1' ' B' ' 80' ' ' VAL . 1.9 t -91.46 -12.88 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.449 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.528 ' CG1' ' HD3' ' B' ' 33' ' ' LYS . 75.3 t -84.34 -25.28 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.051 -1.031 . . . . 0.0 108.793 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -88.22 -33.93 17.95 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -51.28 8.23 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.429 -0.795 . . . . 0.0 108.956 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.523 HG23 ' CD1' ' B' ' 60' ' ' LEU . 1.3 p -59.59 -40.61 82.54 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 O-C-N 121.208 -0.932 . . . . 0.0 108.92 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.527 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -42.17 -48.39 4.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.578 -0.701 . . . . 0.0 109.42 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.61 -43.2 99.41 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.291 -0.881 . . . . 0.0 109.071 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 8.3 m -66.27 -13.69 60.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.31 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.529 ' CD2' ' HB2' ' B' ' 76' ' ' PHE . 2.1 mp -95.29 -28.79 14.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 0.0 109.469 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.417 ' O ' ' C ' ' B' ' 62' ' ' ASN . 0.5 OUTLIER -65.46 114.32 4.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.214 -0.929 . . . . 0.0 109.535 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' B' ' 61' ' ' ASP . 0.4 OUTLIER -44.31 -37.65 3.42 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 0.0 109.363 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 179.29 32.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.0 109.675 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 93.44 1.71 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.52 -35.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.339 -1.095 . . . . 0.0 108.446 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 101.36 38.61 3.23 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.516 ' CB ' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -143.5 104.39 4.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -1.134 . . . . 0.0 109.425 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.521 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.6 t -69.69 156.54 38.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.858 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.472 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -115.46 171.61 7.61 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.483 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -59.03 -50.84 72.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.156 -0.965 . . . . 0.0 110.357 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.489 ' HB3' ' CE ' ' A' ' 79' ' ' MET . 0.9 OUTLIER -56.24 -39.4 72.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.254 -0.904 . . . . 0.0 109.161 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.472 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 1.1 mt-10 -79.59 -16.07 56.52 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.463 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.572 ' CZ ' HG13 ' B' ' 13' ' ' VAL . 54.3 t80 -69.46 -56.3 7.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.224 -0.922 . . . . 0.0 108.705 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.521 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 10.7 mtt -63.74 -49.32 73.48 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.441 ' HB1' ' HB3' ' A' ' 75' ' ' ALA . . . -59.44 -26.36 65.13 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.304 -0.872 . . . . 0.0 108.963 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.584 ' CD2' HG21 ' B' ' 77' ' ' VAL . 0.1 OUTLIER -64.6 -70.59 0.22 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.408 -0.807 . . . . 0.0 108.862 179.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.584 HG21 ' CD2' ' B' ' 76' ' ' PHE . 87.9 t -56.42 -20.61 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.25 -0.906 . . . . 0.0 108.958 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.536 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -64.25 -54.38 34.22 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.46 -0.775 . . . . 0.0 109.423 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.565 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 0.4 OUTLIER -68.24 -61.36 1.88 Allowed 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.345 -0.847 . . . . 0.0 109.652 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.52 ' CG1' HG13 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -48.43 -22.08 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.361 -1.462 . . . . 0.0 109.376 -179.402 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 3.6 m -79.23 -69.94 0.54 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.039 -1.038 . . . . 0.0 109.185 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.8 t -73.82 -49.17 26.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.063 -1.023 . . . . 0.0 109.227 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.565 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -36.55 -43.84 0.42 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.756 -0.59 . . . . 0.0 109.893 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.53 -50.33 71.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.469 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -10.12 49.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.295 -0.878 . . . . 0.0 109.53 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' B' ' 82' ' ' THR . 20.9 mt-10 -73.72 -19.02 60.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 109.539 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -50.6 -22.26 1.93 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.216 -0.928 . . . . 0.0 109.512 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -70.37 -47.43 60.97 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.246 -0.908 . . . . 0.0 109.499 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' B' ' 90' ' ' HIS . 11.7 tt0 65.34 25.95 12.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.486 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.58 ' N ' ' CD2' ' B' ' 90' ' ' HIS . 4.5 m170 69.62 124.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.483 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.464 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.28 0.562 . . . . 0.0 109.487 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.525 ' HG3' ' CB ' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -64.05 -70.82 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.225 -0.922 . . . . 0.0 109.525 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.586 ' CD1' ' CD2' ' B' ' 10' ' ' LEU . 3.7 mm? -75.37 -32.5 60.85 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.464 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.0 OUTLIER -60.25 -60.29 4.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.272 -0.892 . . . . 0.0 109.559 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -63.07 -30.51 71.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -0.914 . . . . 0.0 109.507 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -75.4 -18.12 60.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.484 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.517 ' CG ' HD13 ' A' ' 11' ' ' ILE . 42.4 ttm -80.93 -48.88 11.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.459 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 42.5 t -68.29 -29.62 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 109.508 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -69.9 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.597 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.544 ' CD1' ' CD1' ' B' ' 10' ' ' LEU . 13.2 mt -46.0 -47.01 16.8 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 0.0 109.559 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.517 HD13 ' CG ' ' A' ' 7' ' ' MET . 12.3 mt -60.39 -41.16 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.933 . . . . 0.0 109.491 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.499 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 37.6 t0 -63.03 -21.4 66.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.493 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.572 HG13 ' CE1' ' A' ' 73' ' ' PHE . 2.3 t -84.11 -31.37 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.928 . . . . 0.0 109.391 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 15.1 t80 -68.0 -44.66 76.08 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.017 -1.052 . . . . 0.0 109.21 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.492 ' CD2' ' HD3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -80.83 -41.13 23.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.296 -0.877 . . . . 0.0 109.501 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.499 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 9.8 tt0 -60.16 -61.63 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.95 . . . . 0.0 109.443 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.581 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 32.7 m-85 -57.28 -50.66 72.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.524 ' CA ' HD22 ' A' ' 27' ' ' LEU . 38.1 t -61.24 -18.72 59.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.618 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.455 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -64.68 -31.8 82.1 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.417 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -70.3 -43.38 70.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.273 -1.134 . . . . 0.0 109.481 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 18' ' ' SER . 22.2 tp10 -97.06 135.04 39.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.263 -0.898 . . . . 0.0 109.442 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 52.85 -145.78 19.46 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 0.4 OUTLIER -80.38 -74.65 0.3 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -1.137 . . . . 0.0 109.491 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.492 ' HD3' ' CD2' ' A' ' 15' ' ' HIS . 0.0 OUTLIER 168.79 46.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 109.424 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.32 -14.72 7.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.0 109.695 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.522 ' CG ' ' HB3' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -149.04 170.08 19.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 0.0 109.613 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.524 HD22 ' CA ' ' A' ' 18' ' ' SER . 96.4 mt -118.01 127.08 53.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.776 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 30' ' ' SER . 4.3 tttp -69.81 152.89 44.05 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HG3' ' N ' ' A' ' 30' ' ' SER . 4.2 ptpt -37.14 -30.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.453 -0.779 . . . . 0.0 109.847 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.505 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.97 -50.9 15.11 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.247 -0.908 . . . . 0.0 109.38 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 2.1 mp0 -49.91 -43.81 49.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 108.905 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.515 ' CD2' ' HB2' ' A' ' 27' ' ' LEU . 31.3 mt -57.15 -66.82 0.39 Allowed 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.673 -0.642 . . . . 0.0 109.275 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.519 ' HD3' ' CD1' ' A' ' 47' ' ' ILE . 2.5 mttp -41.35 -31.35 0.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -0.835 . . . . 0.0 109.779 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -64.54 -68.61 0.34 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.18 -0.95 . . . . 0.0 109.35 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 3.1 mm? -44.04 -44.79 7.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.549 HG13 ' CZ ' ' A' ' 76' ' ' PHE . 1.5 mp -53.4 -48.09 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.202 -0.937 . . . . 0.0 109.631 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' C ' ' A' ' 38' ' ' ASN . 3.2 m120 -73.97 -67.26 0.62 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.111 -0.993 . . . . 0.0 110.055 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.441 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.5 OUTLIER -40.83 -70.49 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.442 -0.786 . . . . 0.0 110.269 -179.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.467 ' OE2' HG13 ' A' ' 77' ' ' VAL . 31.5 tt0 -67.59 -51.8 46.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.174 -0.954 . . . . 0.0 110.026 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ILE . 2.4 mp -98.15 65.85 1.76 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.199 -0.938 . . . . 0.0 109.572 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.47 ' HA ' ' HA ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -95.22 1.54 54.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.321 -0.862 . . . . 0.0 109.606 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -78.96 -68.36 0.66 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -100.85 12.34 37.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.435 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.583 ' CD1' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -146.56 31.69 0.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.475 -179.949 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 10.4 tp10 -43.79 -75.03 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' A' ' 47' ' ' ILE . 5.7 tm-20 -113.35 30.02 7.53 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.312 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.519 ' CD1' ' HD3' ' A' ' 33' ' ' LYS . 1.5 mt 55.91 106.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.887 . . . . 0.0 109.255 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -43.03 -27.15 0.18 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.3 -0.875 . . . . 0.0 109.562 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.52 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 1.5 mm-40 164.23 63.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.398 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 2.9 mm-40 51.62 48.82 22.15 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.253 -0.905 . . . . 0.0 109.329 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -87.49 -70.07 0.65 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.588 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.533 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 2.5 t -88.16 -22.42 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.226 -0.921 . . . . 0.0 109.601 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.518 ' CG2' HD12 ' A' ' 47' ' ' ILE . 78.8 t -78.9 -29.93 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.068 -1.02 . . . . 0.0 109.262 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 19.5 t0 -77.12 -49.31 15.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.272 -0.892 . . . . 0.0 109.221 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -50.35 51.37 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 57' ' ' MET . 1.9 p -58.43 -49.35 82.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.09 -1.007 . . . . 0.0 109.072 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.563 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 8.5 tpt -41.53 -44.31 2.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.79 . . . . 0.0 109.802 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 26.1 mt-10 -57.01 -48.19 79.06 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.23 -0.919 . . . . 0.0 109.424 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.526 HG23 ' CE ' ' A' ' 79' ' ' MET . 4.7 t -76.23 -9.7 58.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.278 -0.889 . . . . 0.0 109.977 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.543 ' CD2' ' HB2' ' A' ' 76' ' ' PHE . 16.7 mt -87.27 3.05 48.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.491 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 17.8 p-10 -85.46 114.59 22.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.17 -0.956 . . . . 0.0 109.47 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -52.45 -22.0 4.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.506 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 176.99 40.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.91 . . . . 0.0 109.472 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.419 ' O ' ' CG ' ' A' ' 65' ' ' ASP . . . 77.63 90.36 0.32 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 176.28 -32.46 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.277 -1.131 . . . . 0.0 108.579 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.12 -22.36 23.16 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.522 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mm-40 -70.01 106.94 3.4 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -1.115 . . . . 0.0 109.389 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 14.2 t -69.92 157.08 38.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 109.679 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.461 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 34.3 t0 -117.58 171.26 8.13 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -58.74 -50.3 74.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.468 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 2.3 mp0 -56.81 -40.22 75.57 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.819 . . . . 0.0 108.983 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 mt-10 -76.63 -17.15 59.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.428 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.572 ' CE1' HG13 ' A' ' 13' ' ' VAL . 26.4 t80 -71.54 -49.56 39.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.19 -0.944 . . . . 0.0 108.966 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.521 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 9.6 mmt -66.04 -54.31 27.45 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.312 -0.867 . . . . 0.0 109.034 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 79' ' ' MET . . . -60.63 -26.3 66.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.24 -0.913 . . . . 0.0 108.999 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.549 ' CZ ' HG13 ' A' ' 36' ' ' ILE . 0.4 OUTLIER -59.25 -68.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' A' ' 81' ' ' THR . 53.4 t -62.75 -20.53 25.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.552 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -69.19 -30.86 69.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.447 -0.783 . . . . 0.0 109.269 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 20.7 mtp -85.47 -67.53 0.8 Allowed 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.838 0.827 . . . . 0.0 109.072 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.541 ' CG1' ' CD2' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -48.15 -22.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 O-C-N 120.4 -1.438 . . . . 0.0 109.505 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 45.2 m -85.15 -61.1 1.85 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.007 -1.058 . . . . 0.0 108.468 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.572 ' OG1' ' CD2' ' B' ' 70' ' ' PHE . 1.4 m -80.28 -55.27 5.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -35.32 -42.12 0.19 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.276 0.56 . . . . 0.0 109.933 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 87' ' ' PHE . 30.4 t -69.03 -58.88 3.51 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.912 . . . . 0.0 109.463 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.421 ' C ' ' O ' ' A' ' 84' ' ' CYS . 2.1 t60 -44.5 -64.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -49.12 -36.02 17.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.438 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -57.97 -47.76 81.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.309 -0.869 . . . . 0.0 109.474 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.491 ' O ' ' CB ' ' A' ' 89' ' ' GLU . 8.9 m-85 -60.95 -35.95 78.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.205 -0.934 . . . . 0.0 109.442 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.491 ' CB ' ' O ' ' A' ' 88' ' ' PHE . 1.6 tt0 74.31 -164.86 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.269 -0.895 . . . . 0.0 109.484 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.25 54.35 0.97 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.274 -0.891 . . . . 0.0 109.459 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.487 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.49 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 58.4 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.73 -74.9 0.08 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.291 -0.881 . . . . 0.0 109.488 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.508 ' CD1' HG23 ' A' ' 13' ' ' VAL . 3.3 mp -71.16 -28.08 64.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.941 . . . . 0.0 109.488 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.49 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 34.4 tt0 -58.13 -58.3 9.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.394 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -59.49 -50.97 71.85 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.88 . . . . 0.0 109.336 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -61.88 -14.78 37.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.447 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.462 ' HG3' ' OE2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -76.39 -53.64 7.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 2.7 t -62.62 -27.69 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.525 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -80.17 -69.86 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.586 ' CD2' ' CD1' ' A' ' 3' ' ' LEU . 12.1 mt -44.4 -53.17 7.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 109.487 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.632 ' CD1' ' CZ ' ' B' ' 70' ' ' PHE . 22.1 mm -55.61 -58.22 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 109.886 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -51.4 -19.92 1.56 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.034 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.575 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 1.0 OUTLIER -88.58 -36.28 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.034 -1.041 . . . . 0.0 109.595 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.537 ' CD1' ' HB2' ' B' ' 73' ' ' PHE . 27.3 t80 -58.86 -41.64 87.49 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.777 -1.202 . . . . 0.0 108.837 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' B' ' 16' ' ' GLN . 0.3 OUTLIER -80.7 -46.25 15.84 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.334 -0.853 . . . . 0.0 109.252 179.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' B' ' 15' ' ' HIS . 1.7 tt0 -44.72 -40.17 5.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 108.685 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.521 ' O ' ' N ' ' B' ' 19' ' ' GLY . 3.9 m-85 -91.36 -79.23 0.37 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' B' ' 25' ' ' HIS . 32.2 t 37.0 29.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.242 0.544 . . . . 0.0 110.042 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 74.79 51.78 7.66 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -63.49 -10.01 15.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.328 -1.101 . . . . 0.0 109.814 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -93.18 69.91 4.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.998 . . . . 0.0 109.382 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.92 -42.16 1.49 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.459 ' O ' ' O ' ' B' ' 19' ' ' GLY . 1.1 m-20 -141.36 -153.3 0.45 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -1.174 . . . . 0.0 109.455 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.431 ' C ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -176.75 43.13 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.541 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.47 ' N ' ' OG ' ' B' ' 18' ' ' SER . 0.7 OUTLIER -122.44 -16.61 7.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.264 -0.897 . . . . 0.0 109.688 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.07 170.21 7.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.263 -0.898 . . . . 0.0 109.349 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.531 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 12.6 mt -84.94 137.96 32.79 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 2.0 ptmt -109.67 73.12 0.83 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.225 -0.922 . . . . 0.0 109.504 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.462 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 2.4 tttm 61.54 -85.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.4 -0.813 . . . . 0.0 110.037 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 1.7 t -45.63 -39.43 7.75 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.134 -0.978 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.531 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 3.2 mm-40 -47.96 -50.12 28.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.94 -1.1 . . . . 0.0 108.745 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.631 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 1.1 mt -59.14 -55.76 30.89 Favored 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.53 ' CE ' HG13 ' B' ' 53' ' ' VAL . 7.7 mttp -42.56 -33.82 0.76 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.436 -0.79 . . . . 0.0 109.595 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -71.7 -66.14 0.67 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.683 -179.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.577 HD23 ' CE1' ' B' ' 73' ' ' PHE . 0.3 OUTLIER -41.98 -60.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.363 -0.835 . . . . 0.0 110.231 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.522 ' CD1' HG23 ' B' ' 80' ' ' VAL . 80.7 mt -57.4 -53.55 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.326 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.526 ' ND2' ' N ' ' B' ' 37' ' ' ASN . 0.7 OUTLIER -83.39 15.99 2.75 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.132 -0.98 . . . . 0.0 110.36 -179.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.527 ' N ' ' O ' ' B' ' 34' ' ' GLU . 22.6 t30 -135.7 4.28 3.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.523 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 4.7 mp0 -133.19 -37.31 0.98 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.101 -0.999 . . . . 0.0 109.49 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.517 HD23 ' CD1' ' B' ' 44' ' ' LEU . 5.4 mp -75.7 -54.71 6.53 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.15 -0.969 . . . . 0.0 109.407 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.424 ' HA ' ' HG2' ' B' ' 45' ' ' GLU . 0.7 OUTLIER 47.45 24.62 0.5 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.293 -0.88 . . . . 0.0 109.223 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.17 -86.75 0.57 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.299 -0.876 . . . . 0.0 109.524 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -93.68 7.7 43.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.517 ' CD1' HD23 ' B' ' 40' ' ' LEU . 0.5 OUTLIER -109.29 -79.0 0.59 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.212 -0.93 . . . . 0.0 109.502 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' B' ' 46' ' ' GLU . 1.1 mm-40 44.32 90.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 109.335 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' B' ' 47' ' ' ILE . 2.2 mm-40 63.71 16.7 9.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 0.0 109.305 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.528 HG22 HD11 ' B' ' 47' ' ' ILE . 1.6 mt 56.54 109.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.887 . . . . 0.0 109.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.6 ptpt -43.35 -32.48 0.83 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.522 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 4.0 pt-20 179.01 54.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.258 -0.901 . . . . 0.0 109.498 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.528 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 1.8 mt-30 48.45 53.8 11.46 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 55' ' ' LYS . 0.5 OUTLIER -90.21 -70.09 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.285 -0.884 . . . . 0.0 109.798 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.539 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 1.9 t -86.49 -20.2 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 109.75 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.53 HG13 ' CE ' ' B' ' 33' ' ' LYS . 25.4 t -80.71 -36.92 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.056 -1.027 . . . . 0.0 108.892 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.528 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 36.6 t70 -81.6 -28.84 33.55 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.009 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 0.9 OUTLIER -77.66 -43.32 31.7 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.339 -0.85 . . . . 0.0 109.238 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.525 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 15.8 m -57.04 -51.76 64.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 121.181 -0.949 . . . . 0.0 109.656 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.488 ' CE ' ' CD1' ' B' ' 32' ' ' LEU . 1.7 tpt -40.19 -28.42 0.06 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.116 -0.99 . . . . 0.0 109.752 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' B' ' 56' ' ' VAL . 3.7 mt-10 -77.91 -48.4 16.45 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.065 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.48 ' O ' ' C ' ' B' ' 60' ' ' LEU . 38.8 m -74.55 -63.16 1.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.292 -0.88 . . . . 0.0 109.354 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.624 ' CD2' ' CD1' ' B' ' 76' ' ' PHE . 10.5 mt -34.95 -36.81 0.06 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.298 0.57 . . . . 0.0 110.128 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' B' ' 59' ' ' THR . 10.3 t70 -81.89 73.58 8.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 -87.57 -27.04 22.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.88 . . . . 0.0 109.489 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -82.25 -51.5 7.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.902 . . . . 0.0 109.488 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.97 90.72 2.13 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -175.49 -35.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -1.146 . . . . 0.0 108.595 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.62 38.46 2.22 Favored Glycine 0 N--CA 1.485 1.964 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.487 ' HB3' ' NZ ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -153.63 108.06 3.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.315 -1.109 . . . . 0.0 109.493 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.535 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 75.1 m -69.64 156.06 39.54 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.342 -0.849 . . . . 0.0 109.898 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.443 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 8.5 m-20 -117.43 170.29 8.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.358 -0.839 . . . . 0.0 108.944 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.632 ' CZ ' ' CD1' ' B' ' 11' ' ' ILE . 0.1 OUTLIER -48.83 -67.43 0.27 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 111.319 -179.385 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.505 ' NE2' ' HG2' ' B' ' 72' ' ' GLU . 1.5 pp0? -44.21 -27.81 0.45 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.21 -0.931 . . . . 0.0 108.955 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.612 ' O ' ' CD1' ' B' ' 76' ' ' PHE . 4.6 mt-10 -77.38 -43.2 33.6 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.407 -0.808 . . . . 0.0 109.809 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.578 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 12.6 t80 -49.15 -49.18 43.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.925 -1.11 . . . . 0.0 108.988 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.552 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 6.4 mtt -64.0 -41.31 97.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.437 -0.789 . . . . 0.0 109.381 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' B' ' 79' ' ' MET . . . -66.42 -16.3 63.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.269 -0.894 . . . . 0.0 108.747 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.631 ' CD2' ' CD2' ' B' ' 32' ' ' LEU . 13.3 m-30 -75.5 -70.25 0.44 Allowed 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.501 ' O ' ' CB ' ' B' ' 81' ' ' THR . 39.4 t -52.64 -24.89 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.521 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -64.4 -48.04 76.91 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.37 -0.831 . . . . 0.0 109.36 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 67.0 mtp -74.74 -67.54 0.63 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -0.888 . . . . 0.0 109.841 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.539 ' CG1' ' HB ' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.99 -23.44 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 120.435 -1.416 . . . . 0.0 109.704 -178.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.501 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 7.8 m -80.28 -68.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.906 -1.121 . . . . 0.0 108.795 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.5 t -77.65 -49.33 14.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.179 -0.951 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.563 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.46 -37.1 0.18 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.261 0.553 . . . . 0.0 109.791 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 3.1 t -90.05 -35.34 15.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 0.0 109.505 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.46 ' O ' ' HG2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -65.79 -9.99 33.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' B' ' 89' ' ' GLU . 59.8 mt-10 -70.68 -21.06 62.63 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -76.97 -29.78 55.69 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.249 -0.907 . . . . 0.0 109.504 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -86.89 -30.65 21.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 109.484 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.472 ' O ' ' CB ' ' B' ' 90' ' ' HIS . 6.9 pt-20 -130.75 -169.1 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.0 109.495 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.472 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 27.5 t-80 74.0 121.51 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.513 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.482 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.517 ' HB3' ' CA ' ' B' ' 9' ' ' ALA . 3.8 mm-40 -70.22 -51.94 27.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.296 -0.878 . . . . 0.0 109.306 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.578 HD22 ' CZ ' ' B' ' 73' ' ' PHE . 2.0 mp -72.41 -29.45 63.74 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.513 ' CD ' ' CZ ' ' B' ' 43' ' ' PHE . 1.2 tt0 -58.74 -64.5 0.91 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.197 -0.939 . . . . 0.0 109.312 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -43.57 98.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.208 -0.932 . . . . 0.0 109.265 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.529 ' CB ' ' HA ' ' B' ' 6' ' ' ALA . . . -68.41 -9.99 52.19 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.448 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.506 ' CE ' HG13 ' B' ' 77' ' ' VAL . 0.0 OUTLIER -83.64 -52.71 6.22 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.917 . . . . 0.0 109.403 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.01 -20.36 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.862 . . . . 0.0 109.444 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.59 -60.21 2.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.213 -0.93 . . . . 0.0 109.639 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.488 ' CD2' HD22 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -54.7 -38.46 67.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.591 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.516 ' CD1' HG22 ' B' ' 81' ' ' THR . 36.6 mt -68.17 -57.71 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.566 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -56.49 -19.05 13.52 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.277 -0.889 . . . . 0.0 109.46 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.458 HG12 HD23 ' B' ' 3' ' ' LEU . 0.8 OUTLIER -88.38 -29.9 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.138 -0.977 . . . . 0.0 109.253 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 73' ' ' PHE . 6.0 t80 -66.2 -41.4 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.051 -1.03 . . . . 0.0 109.075 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.658 ' CE1' ' CD2' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -78.46 -43.42 27.21 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.884 . . . . 0.0 109.388 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.63 -55.65 20.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -0.925 . . . . 0.0 109.447 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.562 ' CD2' HD21 ' A' ' 35' ' ' LEU . 20.9 m-85 -60.4 -43.75 96.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 109.532 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.511 ' OG ' ' N ' ' A' ' 25' ' ' HIS . 5.5 p -56.92 -22.12 35.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.47 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.446 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -71.23 -35.93 63.78 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 19' ' ' GLY . 42.0 mmm-85 -43.96 -47.14 8.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -1.108 . . . . 0.0 109.464 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' A' ' 22' ' ' GLY . 3.4 tm-20 -70.42 154.67 41.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.461 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.23 -26.41 0.92 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.67 -149.8 0.18 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -174.26 65.6 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.275 -0.891 . . . . 0.0 109.425 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.658 ' CD2' ' CE1' ' A' ' 15' ' ' HIS . 7.3 m80 -169.28 -35.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.576 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' N ' ' HB2' ' A' ' 18' ' ' SER . 22.6 mtmt -129.34 159.6 35.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -0.906 . . . . 0.0 109.492 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.472 ' HB3' ' HB2' ' A' ' 31' ' ' GLU . 7.3 mp -95.2 167.11 11.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 109.454 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -134.39 79.95 1.83 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.552 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 4.1 ttmt 61.81 -85.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 110.3 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.428 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 6.8 m -44.68 -49.65 10.3 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 0.0 110.435 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 63.9 mm-40 -63.11 -34.46 77.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.029 -1.045 . . . . 0.0 109.716 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.545 ' CD2' ' CD1' ' A' ' 60' ' ' LEU . 1.9 mp -61.37 -70.19 0.2 Allowed 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.434 -0.791 . . . . 0.0 109.674 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 9.1 ttmt -42.43 -39.28 2.16 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.332 -0.855 . . . . 0.0 109.75 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -58.7 -56.64 19.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.58 ' HG ' ' CZ ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -46.85 -35.27 6.16 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 109.476 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.62 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 1.2 mp -72.31 -39.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.592 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 57.0 m-80 -78.66 -1.75 35.86 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.185 -0.947 . . . . 0.0 109.809 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.513 ' ND2' ' OH ' ' A' ' 17' ' ' TYR . 21.0 t-20 -107.45 -25.02 11.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.593 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' B' ' 3' ' ' LEU . 3.1 tm-20 -99.42 -44.97 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -0.929 . . . . 0.0 109.505 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.578 ' CB ' ' CD1' ' A' ' 44' ' ' LEU . 3.6 mm? -56.11 -44.92 79.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.217 -0.927 . . . . 0.0 109.407 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.518 ' C ' ' CG ' ' A' ' 42' ' ' HIS . 0.4 OUTLIER 76.04 60.03 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.545 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.518 ' CG ' ' C ' ' A' ' 41' ' ' SER . 5.4 m-70 76.57 -1.43 2.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.263 -0.898 . . . . 0.0 109.657 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.522 ' CB ' ' HB3' ' A' ' 40' ' ' LEU . 1.7 t80 -60.11 -27.1 66.75 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.156 -0.965 . . . . 0.0 109.356 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.578 ' CD1' ' CB ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -113.49 -15.21 12.62 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.277 -0.889 . . . . 0.0 109.324 179.891 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 63.94 61.86 0.92 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.267 -0.896 . . . . 0.0 109.409 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.426 ' O ' ' C ' ' A' ' 47' ' ' ILE . 33.0 tt0 46.38 83.41 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.91 . . . . 0.0 109.385 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.529 ' CD1' HG22 ' A' ' 53' ' ' VAL . 3.9 mp -43.71 143.69 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.293 -0.879 . . . . 0.0 109.469 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 pttt -149.57 -48.7 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.474 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.489 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 87.9 mt-10 -64.81 -10.84 31.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.365 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.489 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 0.8 OUTLIER 75.29 54.28 0.07 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.292 -0.88 . . . . 0.0 109.448 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.83 -70.4 0.68 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.251 -0.906 . . . . 0.0 109.606 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.54 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 2.2 t -92.03 -24.78 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.112 -0.993 . . . . 0.0 109.251 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.529 HG22 ' CD1' ' A' ' 47' ' ' ILE . 39.2 t -78.58 -18.57 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.0 109.36 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.6 t0 -87.69 -37.67 16.5 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.239 -0.913 . . . . 0.0 109.44 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -78.81 -39.21 36.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.54 ' CG2' ' O ' ' A' ' 52' ' ' VAL . 34.0 m -65.08 -46.16 92.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.507 ' CE ' HD23 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -43.51 -25.74 0.17 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.117 -0.989 . . . . 0.0 110.144 -179.6 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.8 OUTLIER -86.39 -47.15 9.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.074 -1.016 . . . . 0.0 109.892 -179.632 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.528 HG23 ' CE ' ' A' ' 79' ' ' MET . 7.2 t -68.98 -9.76 53.92 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.226 -0.921 . . . . 0.0 109.828 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.561 HD23 ' CG ' ' A' ' 76' ' ' PHE . 6.7 mt -94.4 -68.57 0.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.504 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 57' ' ' MET . 49.7 p-10 -65.03 87.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.495 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -82.94 -9.34 59.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.15 -22.43 16.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.235 -0.916 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 79.9 69.14 1.42 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 26.6 t70 178.36 32.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.287 -1.125 . . . . 0.0 108.374 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.43 64.89 3.08 Favored Glycine 0 N--CA 1.482 1.721 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.467 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 6.0 mt-10 -143.9 84.81 1.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.317 -1.108 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 69' ' ' ASP . 16.0 t -69.95 157.08 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 109.724 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.474 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.2 OUTLIER -117.84 171.85 7.78 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.753 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HA ' ' CE2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -59.33 -51.35 70.3 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.248 -0.907 . . . . 0.0 110.412 -179.601 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.464 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 17.6 pt20 -57.27 -40.32 77.46 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.229 -0.92 . . . . 0.0 108.802 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mt-10 -77.36 -16.17 59.02 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.467 -0.77 . . . . 0.0 109.349 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 14' ' ' PHE . 56.9 t80 -70.38 -64.19 0.94 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.526 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 2.7 tpp -58.11 -43.38 87.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.475 ' HB1' ' CB ' ' B' ' 75' ' ' ALA . . . -63.2 -28.03 69.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.439 -0.788 . . . . 0.0 109.126 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.62 ' CZ ' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -62.34 -69.8 0.24 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 108.797 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.3 t -57.07 -22.78 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.529 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -57.69 -52.76 64.1 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.508 -0.745 . . . . 0.0 109.418 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.575 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.7 OUTLIER -73.94 -63.26 1.25 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.436 -0.79 . . . . 0.0 109.923 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.589 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -47.88 -22.14 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 O-C-N 120.314 -1.492 . . . . 0.0 109.378 -179.14 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.526 ' HA ' ' CD1' ' A' ' 40' ' ' LEU . 4.5 m -79.1 -67.77 0.72 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.01 -1.056 . . . . 0.0 108.863 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.57 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -79.43 -49.43 12.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.135 -0.978 . . . . 0.0 108.837 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.575 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -37.85 -34.88 0.12 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.678 -0.639 . . . . 0.0 109.694 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 30.7 t -82.31 -46.13 14.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.493 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -47.03 -25.11 0.75 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.232 -0.918 . . . . 0.0 109.49 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.55 -50.7 13.26 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 0.0 109.508 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.74 -18.96 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.183 -0.948 . . . . 0.0 109.54 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -46.34 -63.28 1.04 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.496 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 4.1 pt-20 -56.35 168.64 0.52 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 109.471 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 39.8 m-70 60.82 177.62 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.879 . . . . 0.0 109.506 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.495 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.456 ' O ' ' HB1' ' B' ' 6' ' ' ALA . 0.8 OUTLIER -64.37 -78.66 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.894 . . . . 0.0 109.769 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.518 ' HB3' ' CB ' ' A' ' 39' ' ' GLU . 90.0 mt -63.01 -25.24 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.126 -0.983 . . . . 0.0 109.892 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.52 ' O ' ' CG ' ' B' ' 7' ' ' MET . 1.0 OUTLIER -69.8 -70.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.127 -0.983 . . . . 0.0 109.537 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.456 ' O ' ' HB1' ' B' ' 9' ' ' ALA . 13.6 tttt -60.28 -17.7 44.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 109.466 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.529 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -85.79 -26.81 25.57 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -0.921 . . . . 0.0 109.765 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.522 ' HG3' ' N ' ' B' ' 8' ' ' VAL . 3.4 ptt? -78.87 -31.74 45.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.128 -0.983 . . . . 0.0 109.474 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.522 ' N ' ' HG3' ' B' ' 7' ' ' MET . 56.0 t -82.39 -39.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.202 -0.936 . . . . 0.0 109.386 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.517 ' CA ' ' HB3' ' A' ' 2' ' ' GLU . . . -66.85 -42.95 84.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.24 -0.913 . . . . 0.0 109.41 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.574 ' HG ' ' CE2' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -68.65 -62.56 1.33 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.406 ' C ' ' O ' ' B' ' 10' ' ' LEU . 85.7 mt -44.98 -41.75 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.181 -0.95 . . . . 0.0 109.209 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.515 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 23.0 t0 -58.83 -61.81 2.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.311 -0.868 . . . . 0.0 109.364 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.559 ' CG1' ' CZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -44.54 -25.45 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.337 -0.852 . . . . 0.0 109.434 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 4.3 t80 -72.32 -49.69 32.54 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.927 -1.108 . . . . 0.0 109.344 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -75.91 -9.99 59.06 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 110.013 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.515 ' CG ' ' O ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -90.2 -61.69 1.63 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.047 -1.033 . . . . 0.0 109.319 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.577 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 34.2 m-85 -57.98 -43.77 86.71 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.573 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.52 ' CA ' HD22 ' B' ' 27' ' ' LEU . 2.7 p -74.64 -14.01 60.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.508 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.522 ' CA ' ' HG2' ' B' ' 24' ' ' LYS . . . -92.54 8.98 76.65 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.493 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 54.7 mtp85 -87.81 -59.88 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -1.15 . . . . 0.0 109.396 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.2 OUTLIER -80.33 170.11 16.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.298 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' B' ' 23' ' ' ASP . . . -52.01 89.46 0.01 OUTLIER Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' B' ' 22' ' ' GLY . 0.5 OUTLIER 162.39 -164.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -1.084 . . . . 0.0 109.365 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.522 ' HG2' ' CA ' ' B' ' 19' ' ' GLY . 0.0 OUTLIER 171.05 58.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.236 -0.915 . . . . 0.0 109.458 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 16.5 t60 -170.27 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.302 -0.874 . . . . 0.0 109.643 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.524 ' CE ' ' HB3' ' B' ' 67' ' ' GLU . 1.4 ptmt -127.03 166.03 18.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.202 -0.936 . . . . 0.0 109.574 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.532 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 20.7 mt -121.16 130.62 53.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.265 -0.897 . . . . 0.0 109.859 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' B' ' 29' ' ' LYS . 5.0 ttpt -69.6 155.54 40.33 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -39.98 -38.68 0.74 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.185 -0.947 . . . . 0.0 109.732 -179.464 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.33 -46.15 71.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.324 -0.86 . . . . 0.0 109.582 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.532 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -53.03 -44.62 67.5 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.021 -1.049 . . . . 0.0 108.352 179.62 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.545 ' CD1' HD21 ' B' ' 60' ' ' LEU . 3.6 mm? -51.78 -70.71 0.08 Allowed 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.527 ' CA ' HG13 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -37.28 -33.11 0.05 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.731 -0.606 . . . . 0.0 110.146 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.448 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -69.84 -61.03 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.137 -0.977 . . . . 0.0 109.635 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.577 ' HG ' ' CZ ' ' B' ' 17' ' ' TYR . 0.7 OUTLIER -53.04 -20.6 3.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.332 -0.855 . . . . 0.0 110.052 -179.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.579 HD12 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -82.42 -49.06 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.047 -1.033 . . . . 0.0 109.391 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.77 0.05 19.31 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.182 -0.949 . . . . 0.0 109.462 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.44 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 0.6 OUTLIER -118.73 -22.33 7.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.163 -0.96 . . . . 0.0 109.576 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.59 ' CG ' ' CD2' ' B' ' 40' ' ' LEU . 18.5 pt-20 -91.59 -45.07 8.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.59 ' CD2' ' CG ' ' B' ' 39' ' ' GLU . 0.8 OUTLIER -84.19 -50.6 7.75 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 108.616 179.348 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.472 ' O ' ' CB ' ' B' ' 42' ' ' HIS . 0.0 OUTLIER 52.1 65.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.591 -0.693 . . . . 0.0 109.657 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.472 ' CB ' ' O ' ' B' ' 41' ' ' SER . 0.0 OUTLIER 74.43 -0.01 3.46 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.304 -0.872 . . . . 0.0 109.647 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 40' ' ' LEU . 1.2 m-85 -57.91 -36.1 71.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.047 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.548 ' CD2' ' HG ' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -124.02 -22.07 4.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.357 -0.84 . . . . 0.0 109.64 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' B' ' 44' ' ' LEU . 13.0 pt-20 39.68 65.44 0.71 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.393 -0.817 . . . . 0.0 109.76 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.537 ' OE1' ' CG2' ' B' ' 52' ' ' VAL . 0.2 OUTLIER -129.14 -18.5 3.68 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.309 -179.453 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.531 HG22 ' CG2' ' B' ' 53' ' ' VAL . 12.0 mt -81.81 72.67 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.973 -1.079 . . . . 0.0 110.048 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.2 pttt -44.85 -27.38 0.51 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.215 -0.928 . . . . 0.0 108.819 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.456 ' HB3' ' O ' ' B' ' 48' ' ' LYS . 10.5 pt-20 178.08 -32.23 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.495 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -165.05 28.02 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.388 -0.82 . . . . 0.0 109.251 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -69.16 -70.77 0.25 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.43 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 2.4 t -91.03 -9.89 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.11 -0.994 . . . . 0.0 109.009 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.531 ' CG2' HG22 ' B' ' 47' ' ' ILE . 10.6 t -84.85 -29.67 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.495 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 17.9 t0 -90.15 -28.88 18.64 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -84.93 -49.81 8.03 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.442 -0.786 . . . . 0.0 109.105 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.538 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 0.8 OUTLIER -63.06 -41.52 93.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.132 -0.98 . . . . 0.0 108.754 179.578 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' B' ' 53' ' ' VAL . 0.9 OUTLIER -43.06 -46.09 5.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.481 -0.762 . . . . 0.0 109.238 179.605 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -60.66 -48.25 82.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.227 -0.92 . . . . 0.0 109.009 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.435 ' O ' HG21 ' B' ' 59' ' ' THR . 4.0 m -64.36 -13.95 53.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.352 -0.843 . . . . 0.0 109.196 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.545 HD21 ' CD1' ' B' ' 32' ' ' LEU . 2.6 mp -92.25 -81.41 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.336 -0.853 . . . . 0.0 109.494 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' B' ' 57' ' ' MET . 46.1 p-10 -59.17 89.17 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' B' ' 60' ' ' LEU . 0.2 OUTLIER -103.01 -1.66 28.9 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.621 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . 0.427 ' HB2' ' OE2' ' B' ' 67' ' ' GLU . 0.7 OUTLIER -81.54 -9.34 59.71 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.118 -0.989 . . . . 0.0 109.488 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.39 81.85 0.43 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.72 -32.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.242 -1.152 . . . . 0.0 108.635 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.08 37.34 1.84 Allowed Glycine 0 N--CA 1.486 1.981 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.524 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -129.61 149.25 51.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.258 -1.142 . . . . 0.0 109.467 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 10.2 t -95.58 155.61 16.67 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.699 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.465 ' HB3' ' HG2' ' B' ' 72' ' ' GLU . 17.2 t70 -121.39 171.18 8.95 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.453 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.1 OUTLIER -60.26 -54.29 47.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.135 -0.978 . . . . 0.0 110.334 -179.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.507 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 1.9 pt20 -56.55 -21.72 28.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.086 -1.009 . . . . 0.0 108.815 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' B' ' 76' ' ' PHE . 14.9 mm-40 -84.61 -30.46 24.94 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.559 -0.713 . . . . 0.0 109.159 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.578 ' CZ ' HD22 ' A' ' 3' ' ' LEU . 37.1 t80 -62.85 -47.03 85.14 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.407 -0.808 . . . . 0.0 109.083 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.529 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 3.1 mtt -70.33 -56.63 6.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.348 -0.845 . . . . 0.0 109.301 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.475 ' CB ' ' HB1' ' A' ' 75' ' ' ALA . . . -59.43 -16.08 21.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 108.928 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.579 ' CE1' HD12 ' B' ' 36' ' ' ILE . 2.5 t80 -72.49 -68.99 0.43 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.512 -0.742 . . . . 0.0 109.137 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.506 HG13 ' CE ' ' A' ' 7' ' ' MET . 42.7 t -56.1 -27.92 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.259 -0.901 . . . . 0.0 109.162 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.526 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -67.16 -36.46 81.85 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.378 -0.826 . . . . 0.0 109.5 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.538 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 0.0 OUTLIER -77.08 -68.16 0.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 109.557 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.568 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -46.41 -24.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 O-C-N 120.606 -1.309 . . . . 0.0 109.068 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.516 HG22 ' CD1' ' A' ' 11' ' ' ILE . 8.8 m -76.77 -69.19 0.53 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.142 -0.974 . . . . 0.0 109.395 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.4 t -75.34 -49.55 18.76 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.04 -1.037 . . . . 0.0 108.922 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.574 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.38 -30.33 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.761 -0.587 . . . . 0.0 109.775 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' B' ' 82' ' ' THR . 15.7 t -81.4 -46.65 14.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.304 -0.872 . . . . 0.0 109.604 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.574 ' O ' ' CD1' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -67.36 -9.85 45.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' ' O ' ' B' ' 89' ' ' GLU . 4.1 mm-40 -83.99 -15.78 46.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 109.598 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -30.84 71.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.892 . . . . 0.0 109.605 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' B' ' 85' ' ' HIS . 0.6 OUTLIER -47.78 -26.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.234 -0.917 . . . . 0.0 109.557 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' B' ' 90' ' ' HIS . 3.3 tp10 -157.34 150.59 23.74 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 109.422 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.451 ' N ' ' HG3' ' B' ' 89' ' ' GLU . 58.9 t-80 -116.16 169.18 9.47 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . 0.442 ' HG3' ' OXT' ' B' ' 91' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 117.965 -1.017 . . . . 0.0 109.486 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.277 0.56 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.526 ' HB3' ' CB ' ' B' ' 9' ' ' ALA . 2.9 mm-40 -68.76 -48.94 62.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.241 -0.912 . . . . 0.0 109.272 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.585 ' CD1' ' CD2' ' B' ' 35' ' ' LEU . 5.5 mt -78.99 -23.3 44.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.31 -0.869 . . . . 0.0 109.423 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.71 -61.99 2.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.127 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.44 -41.72 96.4 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.292 -0.88 . . . . 0.0 109.183 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.518 ' HB3' ' CB ' ' B' ' 6' ' ' ALA . . . -70.94 -10.77 60.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.385 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 3' ' ' LEU . 2.7 mtp -82.07 -54.84 4.97 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.197 -0.939 . . . . 0.0 109.289 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 31.5 t -62.21 -32.76 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.328 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.46 ' HB3' ' HG2' ' B' ' 2' ' ' GLU . . . -73.17 -65.9 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.272 -0.892 . . . . 0.0 109.527 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.7 mt -44.47 -34.53 2.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.207 -0.933 . . . . 0.0 109.335 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.39 -52.24 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.921 . . . . 0.0 109.361 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.53 -19.81 40.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.229 -0.919 . . . . 0.0 109.222 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.574 HG13 ' CZ ' ' A' ' 73' ' ' PHE . 1.3 t -83.4 -29.78 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.338 -0.851 . . . . 0.0 109.333 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 46.7 t80 -70.5 -42.71 70.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.918 -1.114 . . . . 0.0 109.138 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.33 -34.12 36.93 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.31 -0.869 . . . . 0.0 109.492 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.21 -62.13 1.58 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.206 -0.934 . . . . 0.0 109.445 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.576 ' CD1' HD22 ' A' ' 35' ' ' LEU . 28.2 m-85 -56.6 -47.22 80.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.304 -0.873 . . . . 0.0 109.413 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.513 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 4.6 p -70.0 -17.56 63.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.478 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.468 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -91.26 15.31 61.47 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.1 mmt85 -89.61 -43.19 10.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.25 -1.147 . . . . 0.0 109.483 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 20' ' ' ARG . 7.0 mt-10 -164.9 119.73 1.35 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.252 -0.905 . . . . 0.0 109.47 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.12 -117.3 1.09 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 22.4 m-20 -115.48 -2.99 12.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -1.161 . . . . 0.0 109.671 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 0.6 OUTLIER 76.25 17.7 2.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 109.502 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -142.04 10.82 1.97 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 109.482 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -170.14 167.36 8.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.196 -0.94 . . . . 0.0 109.499 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD21 ' N ' ' A' ' 32' ' ' LEU . 6.3 mp -100.31 164.78 11.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -0.932 . . . . 0.0 109.442 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 1.7 ptmm? -128.4 74.85 1.58 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.25 -0.906 . . . . 0.0 109.479 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 11.4 ttmt 61.83 -85.57 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.395 -0.816 . . . . 0.0 110.206 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.466 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -44.8 -48.41 10.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 78.5 mm-40 -56.02 -40.55 73.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 109.302 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.56 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 38.8 mt -60.06 -69.97 0.19 Allowed 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.633 -0.667 . . . . 0.0 109.571 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 37' ' ' ASN . 14.2 ttmt -42.54 -27.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.318 -0.864 . . . . 0.0 109.729 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' N ' ' OE1' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -66.54 -54.32 25.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 109.469 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.576 HD22 ' CD1' ' A' ' 17' ' ' TYR . 16.1 mt -53.49 -37.49 62.78 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.676 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.633 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 3.1 mm -69.0 -38.7 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.553 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 33' ' ' LYS . 7.2 m120 -82.88 -6.63 59.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 109.661 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.422 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -99.69 -18.24 17.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.514 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.525 ' OE1' ' CG1' ' A' ' 77' ' ' VAL . 19.6 tt0 -111.04 -57.57 2.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.229 -0.919 . . . . 0.0 109.544 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.52 ' O ' ' CB ' ' A' ' 41' ' ' SER . 6.3 mp -65.5 -53.69 38.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.267 -0.896 . . . . 0.0 109.52 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER 162.84 -86.82 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.336 -0.853 . . . . 0.0 109.329 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 1.9 m-70 -141.31 -41.85 0.38 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.278 -0.889 . . . . 0.0 109.368 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.519 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -158.45 21.7 0.23 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.597 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 0.1 OUTLIER 36.04 -93.58 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.698 -0.626 . . . . 0.0 110.167 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -95.32 -83.16 0.36 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.168 -0.957 . . . . 0.0 109.653 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -132.71 41.42 3.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.206 -0.934 . . . . 0.0 109.408 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.528 ' CD1' HG13 ' A' ' 80' ' ' VAL . 1.6 mt -58.26 -50.88 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.42 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER -40.78 -25.81 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.434 -0.791 . . . . 0.0 109.678 -179.754 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -95.64 41.7 1.1 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.211 179.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.45 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 10.0 mt-30 45.9 48.12 12.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.899 . . . . 0.0 109.515 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -90.14 -70.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.288 -0.883 . . . . 0.0 109.536 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.544 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 1.7 t -92.37 -15.58 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.199 -0.938 . . . . 0.0 109.168 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.515 ' CG2' HG21 ' A' ' 47' ' ' ILE . 42.5 t -81.71 -23.57 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 108.896 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 1.1 t0 -86.19 -30.26 22.56 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.32 -0.862 . . . . 0.0 109.085 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.489 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -82.65 -46.15 13.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 0.0 109.217 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.53 ' CG2' ' O ' ' A' ' 52' ' ' VAL . 35.3 m -58.37 -43.79 87.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.181 -0.949 . . . . 0.0 109.544 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.454 ' O ' ' SD ' ' A' ' 57' ' ' MET . 0.0 OUTLIER -48.2 -28.47 3.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.086 -1.009 . . . . 0.0 109.99 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.536 ' HG3' ' N ' ' A' ' 59' ' ' THR . 1.2 pp20? -82.58 -34.64 27.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.043 -1.036 . . . . 0.0 109.719 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.536 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 16.9 m -78.31 -64.84 1.07 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.177 -0.952 . . . . 0.0 109.267 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.646 ' CD2' ' CG ' ' A' ' 76' ' ' PHE . 8.8 mp -39.41 -31.6 0.09 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.608 -0.682 . . . . 0.0 109.791 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' THR . 0.4 OUTLIER -43.96 105.84 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 61' ' ' ASP . 18.9 t-20 -44.93 -48.53 11.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -178.61 31.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.245 -0.91 . . . . 0.0 109.575 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.02 90.78 1.54 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -175.82 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.286 -1.126 . . . . 0.0 108.509 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.24 27.21 6.62 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.513 ' HB2' ' CG ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -138.13 119.07 14.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.256 -1.143 . . . . 0.0 109.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.0 t -69.89 158.61 35.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.215 -0.928 . . . . 0.0 109.782 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.526 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.75 172.12 7.58 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 1.5 t80 -60.16 -56.2 24.51 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.885 . . . . 0.0 110.585 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.538 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 1.6 mp0 -57.27 -31.18 65.34 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.886 . . . . 0.0 109.275 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.526 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 0.1 OUTLIER -79.18 -23.9 43.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.392 -0.817 . . . . 0.0 108.986 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.574 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 1.9 t80 -65.34 -58.04 6.9 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.416 -0.802 . . . . 0.0 108.952 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.527 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.24 -41.57 93.44 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.26 -0.9 . . . . 0.0 109.028 179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' B' ' 75' ' ' ALA . . . -63.44 -26.07 68.56 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.081 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.646 ' CG ' ' CD2' ' A' ' 60' ' ' LEU . 2.1 t80 -67.79 -63.59 1.03 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.352 -0.843 . . . . 0.0 109.31 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.525 ' CG1' ' OE1' ' A' ' 39' ' ' GLU . 25.3 t -58.9 -25.42 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.315 -0.866 . . . . 0.0 108.963 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.538 ' HB1' ' CB ' ' B' ' 74' ' ' MET . . . -68.27 -33.4 74.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.43 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 83' ' ' ALA . 0.6 OUTLIER -81.7 -68.11 0.72 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.571 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -49.08 -21.01 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 O-C-N 120.546 -1.346 . . . . 0.0 110.114 -178.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.549 ' CG2' ' N ' ' A' ' 82' ' ' THR . 5.8 t -87.61 -49.73 6.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.675 -1.265 . . . . 0.0 108.901 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.595 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.1 m -90.57 -56.39 3.22 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.564 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -33.73 -34.16 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.313 0.578 . . . . 0.0 109.913 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' N ' ' O ' ' A' ' 82' ' ' THR . 41.0 t -79.03 -50.17 11.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.227 -0.921 . . . . 0.0 109.529 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.0 OUTLIER -53.78 -56.74 14.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.263 -0.898 . . . . 0.0 109.512 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.438 ' O ' ' OXT' ' A' ' 91' ' ' GLU . 2.4 pt-20 -60.94 -19.76 61.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.562 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -81.63 -26.61 34.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -77.49 -70.04 0.5 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.237 -0.914 . . . . 0.0 109.482 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.433 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 2.7 pt-20 -111.8 168.02 9.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.243 -0.91 . . . . 0.0 109.5 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.433 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER 71.44 43.22 0.63 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.52 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.438 ' OXT' ' O ' ' A' ' 86' ' ' GLU . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.431 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.526 ' OE1' ' CG2' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -63.86 -72.2 0.15 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.587 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.52 ' CB ' ' HG3' ' A' ' 39' ' ' GLU . 0.7 OUTLIER -62.33 -23.13 66.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.335 -0.853 . . . . 0.0 109.696 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -62.56 -62.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.443 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -26.82 68.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.208 -0.933 . . . . 0.0 109.27 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.518 ' CB ' ' HB3' ' A' ' 6' ' ' ALA . . . -74.93 -23.6 58.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 109.429 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -37.75 36.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.266 -0.896 . . . . 0.0 109.466 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.47 ' O ' HG21 ' B' ' 11' ' ' ILE . 74.8 t -71.07 -35.61 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.26 -0.9 . . . . 0.0 109.642 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' HB3' ' A' ' 2' ' ' GLU . . . -78.21 -56.66 4.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.184 -0.948 . . . . 0.0 109.564 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.567 HD21 ' CZ ' ' B' ' 73' ' ' PHE . 3.5 mt -54.29 -47.03 72.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 109.595 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.541 ' CG2' ' N ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -58.22 -46.89 88.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.137 -0.977 . . . . 0.0 109.425 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.541 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 2.6 m-20 -58.91 -22.74 60.24 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.138 -0.976 . . . . 0.0 109.492 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.57 HG12 ' CD1' ' B' ' 17' ' ' TYR . 1.1 t -85.56 -29.98 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.504 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 49.3 t80 -66.5 -42.24 87.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.798 -1.189 . . . . 0.0 109.246 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -76.83 -41.32 44.7 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -0.917 . . . . 0.0 109.534 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.62 -65.91 0.62 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 0.0 109.516 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.57 ' CD1' HG12 ' B' ' 13' ' ' VAL . 33.0 m-85 -50.75 -41.7 56.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 109.379 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.512 ' HB3' ' N ' ' B' ' 26' ' ' LYS . 1.4 m -88.32 43.05 1.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.276 -0.89 . . . . 0.0 109.468 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.14 -61.05 0.67 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -50.96 -20.62 1.41 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.377 -1.072 . . . . 0.0 110.005 -179.604 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.5 tm-20 -69.68 155.14 40.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.087 -1.008 . . . . 0.0 109.421 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . -43.2 -91.79 0.01 OUTLIER Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.306 -1.518 . . . . 0.0 109.306 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.531 ' O ' ' N ' ' B' ' 25' ' ' HIS . 1.5 m-20 -68.31 86.99 0.29 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.223 -1.163 . . . . 0.0 108.948 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' B' ' 18' ' ' SER . 8.6 pttp -41.97 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.451 -0.781 . . . . 0.0 109.829 -179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 23' ' ' ASP . 1.0 OUTLIER -170.46 -35.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.244 -0.91 . . . . 0.0 109.706 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -128.25 164.63 22.15 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.766 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.544 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 7.5 mp -90.56 164.55 14.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.34 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.488 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -131.32 74.35 1.59 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.325 -0.86 . . . . 0.0 109.346 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER 63.54 -83.21 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.607 -0.683 . . . . 0.0 110.363 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.465 ' O ' ' OE1' ' B' ' 34' ' ' GLU . 1.4 t -45.02 -44.55 10.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.147 -0.97 . . . . 0.0 110.591 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.544 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 19.9 mm-40 -61.87 -39.32 91.5 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.76 -1.213 . . . . 0.0 108.718 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.528 HD22 ' CB ' ' B' ' 27' ' ' LEU . 28.9 mt -55.35 -70.31 0.11 Allowed 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.525 ' CG ' HG12 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -44.45 -28.12 0.53 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.885 . . . . 0.0 109.731 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -67.72 -68.36 0.39 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.126 -0.984 . . . . 0.0 109.558 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.585 ' CD2' ' CD1' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -41.72 -49.32 4.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.389 -0.819 . . . . 0.0 109.862 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.577 HD13 ' CZ ' ' B' ' 76' ' ' PHE . 6.4 mm -56.0 -58.79 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.155 -0.965 . . . . 0.0 109.567 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.523 ' OD1' ' CG1' ' B' ' 47' ' ' ILE . 0.7 OUTLIER -85.06 15.19 4.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.0 109.844 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' B' ' 34' ' ' GLU . 5.2 m-20 -116.63 -8.97 11.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.473 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.524 ' HG2' ' CG ' ' A' ' 3' ' ' LEU . 12.5 mp0 -133.78 -44.38 0.81 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.568 ' CD1' ' CD2' ' B' ' 44' ' ' LEU . 3.8 mm? -56.49 -62.7 1.55 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.212 -0.93 . . . . 0.0 109.202 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER 80.58 -70.57 0.08 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.699 . . . . 0.0 110.62 179.25 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.86 -1.81 1.38 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.8 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.48 ' HB3' HD22 ' B' ' 44' ' ' LEU . 5.3 t80 -61.82 -13.97 28.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.801 -1.187 . . . . 0.0 108.835 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.568 ' CD2' ' CD1' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -136.81 12.26 3.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.384 -0.823 . . . . 0.0 109.165 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 46' ' ' GLU . 4.1 mt-10 64.15 38.29 8.38 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.219 -0.925 . . . . 0.0 109.375 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 45' ' ' GLU . 1.8 mt-10 51.53 176.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 109.376 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.528 ' CD1' HG22 ' B' ' 53' ' ' VAL . 1.5 mm -85.56 87.39 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.39 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.485 ' CE ' ' OE2' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -43.38 -48.2 6.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.478 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -158.51 58.09 0.45 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.231 -0.918 . . . . 0.0 109.278 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.46 ' O ' ' CB ' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 62.35 36.23 14.58 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.257 -0.902 . . . . 0.0 109.294 -179.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' B' ' 48' ' ' LYS . 3.1 tt0 -65.18 -70.14 0.25 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.338 -0.851 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.542 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 2.5 t -88.57 -15.67 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.221 -0.925 . . . . 0.0 109.414 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.528 HG22 ' CD1' ' B' ' 47' ' ' ILE . 52.3 t -78.93 -30.38 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.087 -1.008 . . . . 0.0 108.927 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' B' ' 50' ' ' GLN . 21.0 t0 -82.82 -36.86 25.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.291 -0.881 . . . . 0.0 109.069 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -72.01 -47.43 51.98 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 0.0 109.208 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.576 ' CG2' ' CZ ' ' B' ' 76' ' ' PHE . 33.9 m -59.84 -45.73 94.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 O-C-N 121.252 -0.905 . . . . 0.0 109.391 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.444 ' O ' ' SD ' ' B' ' 57' ' ' MET . 0.0 OUTLIER -43.22 -24.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.878 -1.139 . . . . 0.0 109.977 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.8 tt0 -88.29 -45.86 9.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.11 -0.993 . . . . 0.0 110.377 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.485 HG21 ' O ' ' B' ' 56' ' ' VAL . 8.5 t -69.82 -52.91 21.0 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.913 -1.117 . . . . 0.0 110.003 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.582 HD12 ' CE2' ' B' ' 76' ' ' PHE . 5.6 mt -44.81 -65.27 0.55 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.986 -1.071 . . . . 0.0 109.093 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.408 ' OD2' ' HA2' ' B' ' 66' ' ' GLY . 43.1 t0 -45.55 102.61 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 109.496 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.54 11.06 7.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' B' ' 65' ' ' ASP . 3.4 p30 -111.39 -13.69 13.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 109.438 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.89 77.34 1.0 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.411 ' HB2' ' OD1' ' B' ' 63' ' ' ASP . 0.4 OUTLIER 178.14 -33.24 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.222 -1.163 . . . . 0.0 108.632 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.408 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.19 4.66 29.04 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.46 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 2.3 mm-40 -98.15 137.81 36.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -1.177 . . . . 0.0 109.446 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.5 t -79.33 159.21 27.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.169 -0.957 . . . . 0.0 109.639 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.503 ' CB ' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -125.69 171.51 10.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.378 -0.826 . . . . 0.0 108.82 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.8 OUTLIER -58.03 -53.31 59.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.224 -0.923 . . . . 0.0 110.27 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.529 ' HG2' ' CG ' ' A' ' 79' ' ' MET . 8.5 mt-30 -58.16 -30.36 66.32 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.358 -0.839 . . . . 0.0 109.025 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.503 ' HG3' ' CB ' ' B' ' 69' ' ' ASP . 6.2 mt-10 -80.44 -22.02 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.433 -0.792 . . . . 0.0 109.278 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.567 ' CZ ' HD21 ' B' ' 10' ' ' LEU . 2.8 t80 -69.26 -61.77 1.65 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.286 -0.884 . . . . 0.0 108.795 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.538 ' CB ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -57.9 -42.51 84.85 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.52 ' HB3' ' CB ' ' A' ' 75' ' ' ALA . . . -61.85 -28.79 69.74 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.582 ' CE2' HD12 ' B' ' 60' ' ' LEU . 0.7 OUTLIER -64.31 -69.64 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.442 -0.786 . . . . 0.0 108.985 179.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' B' ' 81' ' ' THR . 43.1 t -51.93 -26.55 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.307 -0.87 . . . . 0.0 108.804 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.538 ' CB ' ' HA ' ' A' ' 71' ' ' GLN . . . -65.93 -42.97 89.4 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.37 -0.831 . . . . 0.0 109.432 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 26.2 mtm -77.89 -69.56 0.54 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.266 -0.896 . . . . 0.0 109.568 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.542 ' CG1' ' HB ' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.69 -24.15 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 O-C-N 120.683 -1.261 . . . . 0.0 110.026 -178.795 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 23.0 m -82.52 -65.69 0.98 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.854 -1.154 . . . . 0.0 108.594 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.1 m -75.59 -54.58 6.77 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.553 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -34.89 -46.74 0.32 Allowed 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.213 0.53 . . . . 0.0 110.186 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.452 ' SG ' ' HA ' ' B' ' 44' ' ' LEU . 54.0 t -64.71 -49.74 69.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.213 -0.929 . . . . 0.0 109.585 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -16.88 35.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.892 . . . . 0.0 109.548 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -90.1 -27.02 19.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.926 . . . . 0.0 109.504 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -80.94 -31.95 34.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.546 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -45.68 -57.27 4.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 109.469 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.8 97.82 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.257 -0.902 . . . . 0.0 109.49 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -92.38 125.04 36.87 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.508 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.491 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.462 ' HB3' ' CB ' ' B' ' 9' ' ' ALA . 3.8 mm-40 -69.71 -60.87 2.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.307 -0.871 . . . . 0.0 109.438 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -66.32 -21.67 66.26 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.293 -0.88 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 7' ' ' MET . 25.9 mm-40 -63.99 -67.08 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.288 -0.882 . . . . 0.0 109.26 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 8' ' ' VAL . 10.1 mmtt -59.53 -44.89 93.07 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.212 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -62.86 -20.94 65.6 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.31 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.467 ' O ' HD11 ' A' ' 11' ' ' ILE . 59.5 ttp -72.9 -53.03 12.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.314 -0.866 . . . . 0.0 109.334 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -64.15 -20.86 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.202 -0.937 . . . . 0.0 109.41 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.504 ' CB ' ' HB3' ' B' ' 2' ' ' GLU . . . -80.84 -69.99 0.56 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 109.748 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.526 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.3 OUTLIER -50.64 -48.54 58.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.65 -179.802 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 1.2 mp -58.58 -50.23 79.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.158 -0.964 . . . . 0.0 109.101 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 45.0 t0 -60.53 -19.15 56.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.108 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.595 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 2.2 t -86.98 -26.17 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.078 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -70.45 -46.15 64.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.025 -1.047 . . . . 0.0 109.109 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -77.68 -34.22 53.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.393 -0.817 . . . . 0.0 109.625 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -69.22 -64.48 0.86 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.0 109.383 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.575 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 12.0 m-85 -51.25 -53.0 39.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 23' ' ' ASP . 1.4 t -63.7 -25.12 68.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.275 -0.891 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.467 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -54.92 -20.26 18.62 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -90.13 -29.44 18.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.256 -1.143 . . . . 0.0 109.658 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -83.35 69.94 10.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -0.931 . . . . 0.0 109.654 -179.838 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 47.02 96.7 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.4 OUTLIER 73.14 -149.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -1.177 . . . . 0.0 109.395 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.22 96.83 2.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.253 -0.905 . . . . 0.0 109.515 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.446 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 34.3 m-70 -145.63 -46.79 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 109.642 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.535 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 mttt -137.03 170.21 16.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 109.621 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.584 ' CD1' ' CD1' ' A' ' 35' ' ' LEU . 85.1 mt -115.5 131.33 56.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.191 -0.943 . . . . 0.0 109.558 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.466 ' O ' HD13 ' A' ' 32' ' ' LEU . 2.8 ptmt -76.78 164.03 26.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.206 -0.934 . . . . 0.0 108.768 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.453 ' HA ' HD11 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -42.5 -27.18 0.14 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.92 . . . . 0.0 109.828 -179.742 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.464 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 3.5 m -77.45 -52.58 8.86 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 110.216 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.535 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 19.1 mm-40 -55.03 -39.1 68.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.307 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.578 ' CD2' ' CD1' ' A' ' 60' ' ' LEU . 0.9 OUTLIER -62.56 -70.17 0.22 Allowed 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.544 -0.723 . . . . 0.0 109.431 179.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -43.03 -26.61 0.15 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.165 -0.96 . . . . 0.0 109.586 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.492 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -71.4 -51.58 23.25 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.116 -0.99 . . . . 0.0 109.455 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.595 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 2.3 mt -60.15 -51.19 70.64 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.311 -0.868 . . . . 0.0 109.856 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.584 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 89.8 mt -62.08 -34.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 109.588 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 2.1 m-80 -92.46 -0.95 57.3 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.679 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 34' ' ' GLU . 0.8 OUTLIER -93.83 -43.44 8.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.529 ' CG ' ' HB2' ' B' ' 3' ' ' LEU . 54.5 mp0 -122.7 -10.06 8.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.31 -0.869 . . . . 0.0 109.4 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 36' ' ' ILE . 2.0 mp -108.6 -6.82 15.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.471 ' HB3' ' HA ' ' A' ' 37' ' ' ASN . 1.9 p -64.55 -10.73 27.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -0.938 . . . . 0.0 109.478 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -98.1 -65.0 0.99 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.402 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.15 -47.26 68.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.252 -0.905 . . . . 0.0 109.314 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.557 ' CD2' ' CG1' ' A' ' 80' ' ' VAL . 7.7 mp -72.63 -91.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.295 -0.878 . . . . 0.0 109.345 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 1.4 mt-10 162.92 50.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.863 . . . . 0.0 109.378 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER 46.11 42.7 10.09 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.202 -0.937 . . . . 0.0 109.322 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.516 HD13 ' CG2' ' A' ' 53' ' ' VAL . 0.6 OUTLIER 47.3 93.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.261 -0.9 . . . . 0.0 109.195 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -43.51 -26.88 0.24 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 109.534 -179.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 47' ' ' ILE . 1.3 tp10 176.79 55.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.514 ' N ' HG23 ' A' ' 47' ' ' ILE . 13.1 mt-30 57.96 35.46 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.274 -0.891 . . . . 0.0 109.295 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -71.65 -70.15 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.239 -0.913 . . . . 0.0 109.756 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.546 ' CG1' ' HA ' ' A' ' 80' ' ' VAL . 3.3 t -83.42 -11.06 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.067 -1.02 . . . . 0.0 109.68 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.516 ' CG2' HD13 ' A' ' 47' ' ' ILE . 43.0 t -84.23 -37.43 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.828 -1.17 . . . . 0.0 108.32 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.2 t0 -90.2 -22.1 21.84 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 5.0 mttm -87.49 -48.42 7.96 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.488 -0.757 . . . . 0.0 109.207 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.539 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 1.2 p -64.19 -42.63 96.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 O-C-N 121.179 -0.951 . . . . 0.0 109.094 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.576 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 10.7 tpp -43.48 -45.49 6.45 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 5.4 tt0 -61.22 -44.17 97.7 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.236 -0.915 . . . . 0.0 108.827 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.418 ' O ' HG21 ' A' ' 59' ' ' THR . 52.0 m -62.55 -18.92 63.05 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.372 -0.83 . . . . 0.0 109.411 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.639 ' CD1' ' CD1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -91.5 28.82 1.61 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.196 -0.94 . . . . 0.0 108.898 179.571 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.434 ' OD1' ' HA2' ' A' ' 64' ' ' GLY . 6.6 t0 -85.99 98.48 10.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.489 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.9 -23.33 14.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -140.22 9.71 2.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.261 -0.899 . . . . 0.0 109.47 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' HA2' ' OD1' ' A' ' 61' ' ' ASP . . . 69.03 83.62 0.16 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 178.8 -33.55 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.22 -1.164 . . . . 0.0 108.576 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 14.52 13.32 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.535 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 3.3 pt-20 -87.28 114.93 24.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.3 -1.118 . . . . 0.0 109.469 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 18.8 t -69.74 157.79 36.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -120.69 172.15 8.08 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.531 ' CZ ' HG13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.73 -55.96 16.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.085 -1.009 . . . . 0.0 110.129 -179.81 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.488 ' HG3' ' N ' ' A' ' 72' ' ' GLU . 8.4 pt20 -62.14 -39.4 92.46 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 tt0 -78.68 -10.43 59.75 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.565 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 34.2 t80 -73.73 -51.44 16.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.54 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -64.69 -46.99 80.02 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.03 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.519 ' HB1' ' CB ' ' B' ' 75' ' ' ALA . . . -68.32 -20.75 64.77 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.319 -0.863 . . . . 0.0 109.012 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.639 ' CD1' ' CD1' ' A' ' 60' ' ' LEU . 4.6 t80 -66.68 -70.39 0.25 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.192 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.403 HG23 ' CD2' ' B' ' 3' ' ' LEU . 81.5 t -60.18 -30.38 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.236 -0.915 . . . . 0.0 108.934 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.548 ' HB1' ' CB ' ' B' ' 74' ' ' MET . . . -60.29 -41.99 94.53 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.415 -0.803 . . . . 0.0 109.196 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -63.33 -50.74 68.81 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.163 -0.961 . . . . 0.0 108.701 179.503 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.557 ' CG1' ' CD2' ' A' ' 44' ' ' LEU . 1.5 t -65.33 -9.53 7.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.696 0 O-C-N 121.085 -1.009 . . . . 0.0 109.583 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.511 ' CG2' ' SD ' ' B' ' 7' ' ' MET . 52.7 m -86.85 -57.76 2.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.223 -0.923 . . . . 0.0 109.382 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -81.91 -48.81 11.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.162 -0.961 . . . . 0.0 109.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.571 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -39.42 -42.65 1.12 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.704 -0.622 . . . . 0.0 109.871 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.16 -51.3 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.903 . . . . 0.0 109.519 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -74.2 -9.98 59.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 109.497 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.515 ' O ' ' CG ' ' A' ' 89' ' ' GLU . 3.2 mt-10 -75.07 -34.86 61.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' A' ' 86' ' ' GLU . 4.3 t80 -43.8 -29.02 0.48 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 109.593 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.421 ' O ' ' C ' ' A' ' 89' ' ' GLU . 82.4 t80 -90.11 -35.38 15.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.246 -0.909 . . . . 0.0 109.577 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.515 ' CG ' ' O ' ' A' ' 86' ' ' GLU . 0.7 OUTLIER -43.9 155.83 0.07 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.248 -0.908 . . . . 0.0 109.548 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -142.92 -161.69 1.3 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.217 -0.927 . . . . 0.0 109.492 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.504 179.945 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.506 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.504 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 3.6 mm-40 -76.13 -35.85 59.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 109.3 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.529 ' HB2' ' CG ' ' A' ' 39' ' ' GLU . 7.5 mp -78.99 -28.1 43.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.285 -0.885 . . . . 0.0 109.442 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.506 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 4.9 tm-20 -68.84 -58.84 3.6 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.899 . . . . 0.0 109.192 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.524 ' O ' ' CG1' ' B' ' 8' ' ' VAL . 19.4 mttt -62.61 -37.2 85.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.223 -0.923 . . . . 0.0 109.161 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.522 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -66.9 -19.52 65.74 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.38 -0.825 . . . . 0.0 109.308 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.511 ' SD ' ' CG2' ' A' ' 81' ' ' THR . 10.4 tpt -81.84 -38.47 25.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.342 -0.849 . . . . 0.0 109.368 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.524 ' CG1' ' O ' ' B' ' 5' ' ' LYS . 2.6 p -68.27 -30.89 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.286 -0.884 . . . . 0.0 109.413 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.462 ' CB ' ' HB3' ' A' ' 2' ' ' GLU . . . -82.47 -52.46 6.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 109.395 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.594 ' CD1' ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -53.29 -40.87 65.07 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.538 ' CG2' ' N ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -68.86 -46.37 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.376 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.538 ' N ' ' CG2' ' B' ' 11' ' ' ILE . 0.3 OUTLIER -51.89 -26.83 11.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 109.239 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.569 HG11 ' CD1' ' B' ' 17' ' ' TYR . 18.9 t -86.81 -30.87 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.26 -0.9 . . . . 0.0 109.366 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 2.7 t80 -59.48 -56.92 15.92 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.834 -1.166 . . . . 0.0 109.027 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.54 ' CE1' ' HB2' ' B' ' 24' ' ' LYS . 3.4 t60 -72.79 -48.41 38.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 109.636 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 44.9 tt0 -50.5 -68.39 0.18 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.841 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.583 ' CE2' ' CD1' ' B' ' 35' ' ' LEU . 25.4 m-85 -52.97 -32.77 47.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 110.072 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' B' ' 14' ' ' PHE . 86.3 p -87.36 31.57 0.73 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.044 -1.035 . . . . 0.0 109.942 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.02 -0.34 48.21 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.87 -58.27 2.63 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -1.17 . . . . 0.0 109.49 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.49 168.58 18.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.229 -0.92 . . . . 0.0 109.477 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.17 -105.88 3.17 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' B' ' 24' ' ' LYS . 0.2 OUTLIER -148.97 -68.67 0.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -1.143 . . . . 0.0 109.476 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' B' ' 15' ' ' HIS . 2.8 pttt 168.8 39.32 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.91 . . . . 0.0 109.503 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.574 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 3.9 p80 -169.74 27.53 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' B' ' 68' ' ' CYS . 4.5 ptpt -153.97 167.66 29.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.54 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 78.9 mt -138.34 119.2 14.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.226 -0.921 . . . . 0.0 109.874 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.0 OUTLIER -85.77 118.86 25.53 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.279 -0.888 . . . . 0.0 108.666 179.114 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.535 ' N ' ' CE ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER 20.1 -78.76 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' B' ' 28' ' ' LYS . 69.3 p -40.73 -58.42 1.65 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.979 -1.075 . . . . 0.0 110.794 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.54 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 31.1 mm-40 -45.93 -43.84 14.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.903 -1.123 . . . . 0.0 109.166 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.53 ' CD2' ' HB2' ' B' ' 27' ' ' LEU . 20.2 mt -53.26 -66.07 0.45 Allowed 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.56 -0.713 . . . . 0.0 109.12 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.52 ' HA ' ' CD1' ' B' ' 36' ' ' ILE . 0.1 OUTLIER -43.62 -36.27 2.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 109.646 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -54.97 -63.08 1.27 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 109.416 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.583 ' CD1' ' CE2' ' B' ' 17' ' ' TYR . 1.1 mp -50.71 -36.66 37.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.58 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.579 HG13 ' CZ ' ' B' ' 76' ' ' PHE . 4.1 mt -61.43 -39.27 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.706 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.461 ' OD1' ' HE2' ' B' ' 33' ' ' LYS . 0.7 OUTLIER -96.38 -70.08 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 109.679 -179.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -45.72 -24.34 0.35 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.289 -0.882 . . . . 0.0 109.963 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.525 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -113.91 -40.8 3.67 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.077 -1.015 . . . . 0.0 109.941 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 0.1 OUTLIER -109.52 67.98 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.132 -0.98 . . . . 0.0 109.601 -179.821 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 58.5 p -120.65 43.71 2.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.455 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.505 ' CE1' ' HB2' ' B' ' 43' ' ' PHE . 9.5 p80 -129.65 -47.12 1.16 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.512 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.505 ' HB2' ' CE1' ' B' ' 42' ' ' HIS . 0.2 OUTLIER -110.67 9.18 22.88 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.52 ' CD1' HD21 ' B' ' 40' ' ' LEU . 6.5 mp -106.51 -21.62 13.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.256 -0.902 . . . . 0.0 109.489 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.426 ' C ' ' O ' ' B' ' 44' ' ' LEU . 12.9 mt-10 43.8 68.6 0.5 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 63.89 155.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.895 . . . . 0.0 109.465 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.547 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 31.1 mm -64.96 -24.4 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.456 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.2 OUTLIER 84.4 -52.15 0.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.712 -0.618 . . . . 0.0 109.592 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.522 ' N ' ' CG ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -174.21 34.96 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.482 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 5.8 mt-30 73.73 38.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -65.47 -70.26 0.25 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.178 -0.951 . . . . 0.0 109.394 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.583 ' CG1' ' CG1' ' B' ' 80' ' ' VAL . 2.4 t -87.56 -15.41 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.142 -0.974 . . . . 0.0 109.152 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.52 ' CG1' ' HG3' ' B' ' 33' ' ' LYS . 39.5 t -75.17 -29.83 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.204 -0.935 . . . . 0.0 108.746 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 6.1 t0 -90.13 -36.92 14.56 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.425 -0.797 . . . . 0.0 109.314 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.461 ' HA ' ' OE2' ' B' ' 58' ' ' GLU . 23.7 mtpp -70.63 -36.17 73.32 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.316 -0.865 . . . . 0.0 109.534 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.533 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 5.3 m -55.44 -56.13 13.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' B' ' 61' ' ' ASP . 0.2 OUTLIER -41.11 -28.32 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.93 -1.106 . . . . 0.0 109.625 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.464 ' N ' ' O ' ' B' ' 56' ' ' VAL . 45.0 mt-10 -70.06 -55.6 9.09 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' B' ' 60' ' ' LEU . 2.8 m -82.81 -63.06 1.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.584 HD23 ' CD1' ' B' ' 76' ' ' PHE . 1.7 mp -37.2 -36.5 0.14 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.761 -0.587 . . . . 0.0 109.898 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.524 ' CB ' ' O ' ' B' ' 57' ' ' MET . 11.1 t0 -90.11 70.03 7.29 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.398 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -100.09 8.88 43.61 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.9 -10.74 17.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.468 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 63.85 78.39 0.19 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 58.8 t0 178.99 -33.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.25 -1.147 . . . . 0.0 108.602 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 -9.37 31.52 Favored Glycine 0 N--CA 1.486 1.973 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' B' ' 67' ' ' GLU . 12.2 pt-20 -95.56 123.74 39.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -1.148 . . . . 0.0 109.474 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.476 ' SG ' ' CG ' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -69.63 133.42 47.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.273 -0.892 . . . . 0.0 109.338 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.477 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 23.0 t70 -98.05 170.76 8.7 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -55.74 -47.7 76.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.042 . . . . 0.0 110.061 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.458 ' HG2' ' SD ' ' A' ' 79' ' ' MET . 65.6 mt-30 -50.56 -49.31 56.41 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.546 -0.721 . . . . 0.0 109.319 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.53 ' OE1' ' CG ' ' B' ' 60' ' ' LEU . 0.0 OUTLIER -72.17 -20.83 61.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.541 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.594 ' CE2' ' CD1' ' B' ' 10' ' ' LEU . 71.8 t80 -59.86 -57.78 11.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.548 ' CB ' ' HB1' ' A' ' 78' ' ' ALA . 3.4 mtt -66.61 -44.14 82.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.332 -0.855 . . . . 0.0 109.605 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.519 ' CB ' ' HB1' ' A' ' 75' ' ' ALA . . . -68.61 -12.21 61.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.081 -1.012 . . . . 0.0 109.21 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.584 ' CD1' HD23 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -81.52 -70.52 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.337 -0.852 . . . . 0.0 109.282 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.528 ' CG2' HD21 ' B' ' 35' ' ' LEU . 98.5 t -60.59 -30.25 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.88 . . . . 0.0 108.858 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.54 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -66.16 -45.57 80.49 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.459 -0.776 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.535 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 4.3 mmm -63.17 -70.34 0.22 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.059 -1.026 . . . . 0.0 108.914 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.583 ' CG1' ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -41.81 -26.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 120.891 -1.131 . . . . 0.0 109.553 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.488 ' N ' ' O ' ' B' ' 79' ' ' MET . 15.2 m -71.05 -70.23 0.32 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.053 -1.03 . . . . 0.0 108.885 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.0 OUTLIER -79.23 -50.77 10.41 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.113 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.581 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.4 -37.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.262 0.553 . . . . 0.0 109.848 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 8.6 t -84.88 -39.53 18.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 109.557 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.487 ' NE2' ' CE2' ' B' ' 43' ' ' PHE . 0.8 OUTLIER -65.38 -9.98 29.49 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.605 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.492 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 0.5 OUTLIER -87.78 -21.55 25.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.241 -0.912 . . . . 0.0 109.525 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.474 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.9 t80 -43.69 -32.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.286 -0.884 . . . . 0.0 109.519 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.08 -43.48 24.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 109.454 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' B' ' 89' ' ' GLU . 4.0 pm0 -95.06 117.91 30.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.944 . . . . 0.0 109.435 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.45 53.81 0.76 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.259 -0.901 . . . . 0.0 109.469 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.449 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.46 ' N ' ' HB2' ' A' ' 4' ' ' GLU . 1.1 t . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.65 -49.2 28.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.0 109.534 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.516 ' CD2' ' HG ' ' B' ' 10' ' ' LEU . 2.3 mp -76.49 -23.38 53.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.46 ' HB2' ' N ' ' A' ' 1' ' ' SER . 2.0 mt-10 -62.42 -63.91 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.346 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -38.59 90.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.311 -0.868 . . . . 0.0 109.297 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' HB2' ' CB ' ' B' ' 6' ' ' ALA . . . -70.63 -15.55 62.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.298 -0.876 . . . . 0.0 109.428 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.06 -46.49 16.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.316 -0.865 . . . . 0.0 109.385 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.11 -41.93 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.457 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.453 ' CB ' ' OE1' ' B' ' 2' ' ' GLU . . . -67.7 -54.18 21.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.922 . . . . 0.0 109.42 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.569 HD22 ' CZ ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -47.68 -46.37 29.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.2 -0.937 . . . . 0.0 109.397 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.415 HG23 HD11 ' A' ' 11' ' ' ILE . 45.5 mt -59.3 -38.95 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.396 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 91.3 m-20 -64.63 -24.46 67.59 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.262 -0.899 . . . . 0.0 109.532 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.557 HG12 ' CD1' ' A' ' 17' ' ' TYR . 2.7 t -81.01 -29.87 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 10.9 t80 -69.63 -47.77 62.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.941 -1.099 . . . . 0.0 109.507 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -78.99 -33.43 45.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.558 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 39.1 tt0 -68.82 -64.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.907 . . . . 0.0 109.468 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.626 ' CZ ' ' CD1' ' A' ' 35' ' ' LEU . 26.0 m-85 -55.4 -48.23 74.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.5 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 33.7 t -69.64 -19.03 63.62 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.289 -0.882 . . . . 0.0 109.47 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.38 16.09 59.77 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 22.4 mmm180 -81.46 -46.65 14.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.492 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.427 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 1.0 OUTLIER -74.2 169.72 17.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.277 -0.889 . . . . 0.0 109.498 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.54 -52.87 7.28 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.0 -162.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -1.169 . . . . 0.0 109.421 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 179.5 80.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.297 -0.877 . . . . 0.0 109.449 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -152.82 -39.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.527 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -144.13 168.11 20.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.587 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.546 ' HB2' ' CD2' ' A' ' 32' ' ' LEU . 56.6 mt -86.17 152.08 23.12 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.339 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -119.16 69.45 0.82 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.777 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HD3' ' N ' ' A' ' 30' ' ' SER . 1.6 tmtt? 64.48 -81.6 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.518 -0.739 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.508 ' N ' ' HD3' ' A' ' 29' ' ' LYS . 4.3 m -48.28 -32.4 7.25 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.87 -1.144 . . . . 0.0 110.187 -179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.534 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 7.4 mm-40 -64.5 -43.01 95.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.962 -1.086 . . . . 0.0 108.568 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.546 ' CD2' ' HB2' ' A' ' 27' ' ' LEU . 3.2 mm? -55.93 -61.45 2.37 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.467 ' CG ' HG12 ' A' ' 53' ' ' VAL . 2.3 ttmt -52.15 -36.58 51.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.44 -0.788 . . . . 0.0 109.829 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -38.44 79.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 0.0 109.534 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.626 ' CD1' ' CZ ' ' A' ' 17' ' ' TYR . 13.3 tp -75.14 -38.68 60.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.338 -0.851 . . . . 0.0 109.995 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.583 HG12 ' CE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -75.75 -14.16 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 109.744 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.467 ' HA ' ' OG ' ' A' ' 41' ' ' SER . 1.8 m-80 -93.82 -57.02 2.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.973 -1.08 . . . . 0.0 109.756 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -73.92 -10.94 60.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.236 -0.915 . . . . 0.0 109.723 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.519 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 2.5 mm-40 -121.01 -33.31 3.76 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.065 -1.022 . . . . 0.0 109.968 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.526 ' CD2' HD23 ' A' ' 44' ' ' LEU . 7.4 mp -117.9 66.0 0.75 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.047 -1.033 . . . . 0.0 109.606 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.473 ' C ' ' CG ' ' A' ' 46' ' ' GLU . 7.7 m -138.99 26.88 2.42 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -0.878 . . . . 0.0 109.374 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -164.68 -47.57 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.214 -0.929 . . . . 0.0 109.488 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.444 ' HB2' ' OE2' ' B' ' 4' ' ' GLU . 3.8 t80 -65.63 -71.89 0.17 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.526 HD23 ' CD2' ' A' ' 40' ' ' LEU . 0.6 OUTLIER -78.65 -148.47 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.225 -0.922 . . . . 0.0 109.27 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.495 ' CG ' ' SG ' ' A' ' 84' ' ' CYS . 2.1 mm-40 -90.05 107.92 19.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.156 -0.965 . . . . 0.0 109.382 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.473 ' CG ' ' C ' ' A' ' 41' ' ' SER . 2.0 mt-10 -43.73 158.16 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.31 -0.869 . . . . 0.0 109.244 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.586 ' CD1' ' CG2' ' A' ' 53' ' ' VAL . 24.3 mm -69.24 -53.7 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.206 -0.934 . . . . 0.0 109.434 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.7 pttt 39.7 25.22 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.666 -0.646 . . . . 0.0 111.185 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 mt-10 161.13 34.07 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.998 -1.063 . . . . 0.0 110.244 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.532 ' N ' HG21 ' A' ' 47' ' ' ILE . 32.0 mt-30 40.33 37.11 0.39 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.278 -0.889 . . . . 0.0 109.748 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -68.45 -70.51 0.26 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.157 -0.964 . . . . 0.0 109.627 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.531 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.3 t -80.86 -9.78 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.058 -1.026 . . . . 0.0 109.158 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.586 ' CG2' ' CD1' ' A' ' 47' ' ' ILE . 55.9 t -80.83 -45.91 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.19 -0.944 . . . . 0.0 108.939 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.14 -28.3 60.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.457 -0.777 . . . . 0.0 108.959 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -56.33 4.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.39 -0.819 . . . . 0.0 109.257 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.531 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 17.1 m -57.08 -48.15 82.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.054 -1.029 . . . . 0.0 109.542 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.503 ' CE ' ' HA ' ' A' ' 29' ' ' LYS . 19.1 tpp -42.89 -45.14 4.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.205 -0.934 . . . . 0.0 109.68 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.77 -49.25 73.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.18 -0.95 . . . . 0.0 109.489 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.468 HG21 ' HG ' ' A' ' 60' ' ' LEU . 4.5 t -77.53 -8.97 58.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.288 -0.883 . . . . 0.0 109.913 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.538 ' CD2' ' HB2' ' A' ' 76' ' ' PHE . 13.2 mt -97.27 11.58 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 109.397 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -77.97 113.88 16.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.245 -0.909 . . . . 0.0 109.511 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.507 ' ND2' ' HB2' ' A' ' 69' ' ' ASP . 13.6 t-20 -60.28 -50.37 73.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 109.477 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -150.35 16.5 0.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.176 -0.953 . . . . 0.0 109.589 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.08 75.18 1.29 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -176.98 30.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -1.163 . . . . 0.0 108.406 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.463 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 49.31 22.43 3.52 Favored Glycine 0 N--CA 1.482 1.758 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.3 mt-10 -106.76 96.57 6.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -1.141 . . . . 0.0 109.436 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.465 ' HA ' ' OE2' ' A' ' 72' ' ' GLU . 56.3 m -69.97 162.25 28.46 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.218 -0.926 . . . . 0.0 109.835 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.507 ' HB2' ' ND2' ' A' ' 62' ' ' ASN . 20.9 t70 -128.18 170.95 12.4 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -52.55 -51.22 60.74 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.093 -1.004 . . . . 0.0 110.203 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.461 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 0.5 OUTLIER -54.82 -30.6 57.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.28 -0.887 . . . . 0.0 109.103 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' CD2' ' A' ' 60' ' ' LEU . 3.8 mt-10 -82.52 -24.87 33.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.569 ' CZ ' HD22 ' A' ' 10' ' ' LEU . 1.2 t80 -63.93 -57.55 9.44 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.121 -0.987 . . . . 0.0 108.642 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.536 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.1 OUTLIER -64.15 -48.88 74.33 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.343 -0.848 . . . . 0.0 108.763 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' A' ' 71' ' ' GLN . . . -55.52 -25.16 35.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.624 ' CG ' ' N ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -67.29 -69.41 0.31 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.438 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.624 ' N ' ' CG ' ' A' ' 76' ' ' PHE . 40.0 t -53.45 -21.11 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.408 -0.807 . . . . 0.0 109.057 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.515 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -66.05 -50.29 64.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.332 -0.855 . . . . 0.0 109.484 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 44.8 mtp -73.6 -63.56 1.18 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.62 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.525 HG11 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.32 -22.83 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.842 0 O-C-N 120.565 -1.335 . . . . 0.0 109.41 -179.059 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.53 ' CG2' HD12 ' B' ' 11' ' ' ILE . 3.3 m -80.32 -68.83 0.64 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.03 -1.044 . . . . 0.0 109.123 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.8 t -74.32 -49.46 22.87 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.98 -1.075 . . . . 0.0 109.088 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.561 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -37.19 -31.08 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.421 0.629 . . . . 0.0 109.607 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' SG ' ' CG ' ' A' ' 45' ' ' GLU . 10.9 t -81.03 -58.36 3.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.0 109.288 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -45.05 -60.99 1.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.279 -0.888 . . . . 0.0 109.482 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -53.42 -47.53 69.53 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.39 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 58.8 t80 -46.67 -39.02 10.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.516 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -62.68 -53.66 51.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.231 -0.918 . . . . 0.0 109.442 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' A' ' 90' ' ' HIS . 5.0 mt-10 -63.17 169.9 3.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 109.408 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.46 ' O ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER 61.45 135.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.0 109.46 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.509 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.453 ' OE1' ' CB ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -70.96 -70.08 0.33 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.92 . . . . 0.0 109.485 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.556 ' N ' ' CD2' ' B' ' 3' ' ' LEU . 3.3 mm? -75.12 -17.59 60.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.26 -0.9 . . . . 0.0 109.393 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' B' ' 7' ' ' MET . 22.5 tt0 -73.36 -61.72 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.418 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.459 ' O ' HG11 ' B' ' 8' ' ' VAL . 7.4 ttmt -61.0 -51.19 70.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.515 ' CB ' ' HB2' ' A' ' 6' ' ' ALA . . . -58.86 -15.76 14.09 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.505 ' SD ' ' CD1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -82.29 -53.86 5.7 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.496 HG11 ' N ' ' B' ' 9' ' ' ALA . 9.4 p -55.7 -28.55 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.241 -0.912 . . . . 0.0 109.545 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.496 ' N ' HG11 ' B' ' 8' ' ' VAL . . . -78.47 -62.91 1.53 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.516 ' HG ' ' CD2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -50.71 -21.71 1.74 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.931 . . . . 0.0 109.557 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' A' ' 81' ' ' THR . 73.8 mt -77.02 -62.43 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -48.17 -23.39 0.84 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.231 -0.918 . . . . 0.0 109.535 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.501 HG11 ' N ' ' B' ' 14' ' ' PHE . 0.3 OUTLIER -81.61 -40.38 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.513 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 28.1 t80 -57.05 -50.5 72.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.12 -0.987 . . . . 0.0 109.254 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.451 ' HA ' ' HB2' ' B' ' 18' ' ' SER . 14.7 m170 -67.85 -35.92 79.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.412 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -51.56 -57.45 9.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.484 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.635 ' CE2' ' CD1' ' B' ' 35' ' ' LEU . 78.8 m-85 -64.82 -28.05 69.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.225 -0.922 . . . . 0.0 109.482 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 0.6 OUTLIER -65.72 -20.94 66.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.925 . . . . 0.0 109.521 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.51 16.99 59.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 29.5 mmt180 -90.08 -57.48 2.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.256 -1.143 . . . . 0.0 109.432 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 165.73 23.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.297 -0.877 . . . . 0.0 109.409 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.11 -122.59 5.86 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.445 ' HB2' ' HE2' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -94.03 -156.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.292 -1.122 . . . . 0.0 109.517 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' B' ' 25' ' ' HIS . 13.0 mtmm -132.46 28.09 4.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 16.0 m170 -162.46 26.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.268 -0.895 . . . . 0.0 109.47 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.06 143.59 2.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.283 -0.885 . . . . 0.0 109.445 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.54 HD11 ' CB ' ' B' ' 31' ' ' GLU . 0.9 OUTLIER -93.24 167.27 11.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.957 . . . . 0.0 109.555 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.1 OUTLIER -135.7 80.58 1.84 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.388 -0.82 . . . . 0.0 109.369 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 64.0 -84.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.74 . . . . 0.0 110.32 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 29' ' ' LYS . 2.5 m -41.71 -57.51 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.136 -0.978 . . . . 0.0 110.482 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.54 ' CB ' HD11 ' B' ' 27' ' ' LEU . 64.7 mm-40 -61.15 -33.07 72.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.897 -1.127 . . . . 0.0 109.597 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.586 ' CD1' ' CE ' ' B' ' 57' ' ' MET . 52.4 mt -56.0 -68.87 0.17 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.386 -0.821 . . . . 0.0 108.847 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.519 ' CD ' HG13 ' B' ' 53' ' ' VAL . 2.8 mttt -44.15 -33.88 1.66 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.32 -0.863 . . . . 0.0 109.073 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -58.73 -66.57 0.48 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.478 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.635 ' CD1' ' CE2' ' B' ' 17' ' ' TYR . 4.2 mm? -42.7 -40.65 2.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.88 . . . . 0.0 109.737 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.581 HD12 ' CZ ' ' B' ' 76' ' ' PHE . 2.8 mm -59.92 -50.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.227 -0.92 . . . . 0.0 109.687 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.462 ' OD1' ' O ' ' B' ' 44' ' ' LEU . 1.2 m-20 -81.14 6.29 14.25 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.235 -0.915 . . . . 0.0 109.612 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -127.44 7.03 6.35 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.184 -0.947 . . . . 0.0 109.714 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.515 ' HB2' ' CB ' ' A' ' 3' ' ' LEU . 5.8 pt-20 -142.87 -33.74 0.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.177 -0.952 . . . . 0.0 110.155 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.538 ' CD1' ' CD1' ' B' ' 44' ' ' LEU . 3.8 mm? -52.55 -69.07 0.12 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.016 -1.052 . . . . 0.0 109.403 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.9 p 162.24 -54.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.397 -0.815 . . . . 0.0 109.389 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.492 ' CD2' ' HB2' ' B' ' 41' ' ' SER . 4.9 p80 178.73 -36.97 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 109.363 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.4 ' CD2' ' CE1' ' B' ' 42' ' ' HIS . 5.5 m-85 -60.75 -26.56 67.31 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.246 -0.909 . . . . 0.0 109.419 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.538 ' CD1' ' CD1' ' B' ' 40' ' ' LEU . 1.0 OUTLIER -100.88 31.14 3.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.427 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' B' ' 37' ' ' ASN . 88.0 tt0 -47.1 -46.79 23.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.446 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.522 ' O ' ' CB ' ' B' ' 47' ' ' ILE . 1.2 pm0 -129.95 16.69 5.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.282 -0.886 . . . . 0.0 109.418 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.555 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 14.5 mm 82.7 -19.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.678 -0.639 . . . . 0.0 110.247 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 84.58 -36.28 0.06 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.392 -0.818 . . . . 0.0 109.82 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.523 ' N ' ' HG2' ' B' ' 48' ' ' LYS . 5.0 tt0 178.46 33.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.076 -1.015 . . . . 0.0 109.48 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.442 ' HA ' HG22 ' B' ' 47' ' ' ILE . 0.9 OUTLIER 50.14 51.32 16.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.13 -57.28 2.91 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.635 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.501 ' O ' ' HB ' ' B' ' 56' ' ' VAL . 40.1 t -86.97 -13.58 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.655 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.519 HG13 ' CD ' ' B' ' 33' ' ' LYS . 37.7 t -77.47 -15.62 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 120.902 -1.124 . . . . 0.0 109.339 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -48.84 6.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.327 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -72.31 -42.04 65.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.874 . . . . 0.0 109.383 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.631 ' CG2' ' CE1' ' B' ' 76' ' ' PHE . 5.4 p -56.4 -46.48 81.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.203 -0.936 . . . . 0.0 109.386 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' B' ' 32' ' ' LEU . 8.1 tpp -42.79 -47.1 5.43 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.416 -0.802 . . . . 0.0 109.169 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.447 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.9 OUTLIER -57.14 -45.11 83.81 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.749 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.517 HG22 ' CE ' ' B' ' 79' ' ' MET . 3.9 t -75.14 -12.24 60.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.0 110.077 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.579 HD12 ' CE2' ' B' ' 76' ' ' PHE . 34.1 mt -91.12 -9.03 47.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.34 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 17.1 p-10 -62.6 113.39 2.96 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.276 -0.89 . . . . 0.0 109.576 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.516 ' CA ' ' OE2' ' B' ' 72' ' ' GLU . 9.1 p-10 -81.17 -45.89 15.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.266 -0.896 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . 0.43 ' N ' ' CG ' ' B' ' 62' ' ' ASN . 0.6 OUTLIER -131.77 1.0 3.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 75.51 1.2 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -175.3 29.83 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -1.156 . . . . 0.0 108.385 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.3 26.26 6.6 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.452 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 87.0 mt-10 -105.76 111.95 24.83 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -1.136 . . . . 0.0 109.437 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 16.2 t -69.64 159.02 34.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.493 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.3 OUTLIER -130.03 172.54 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.424 -0.797 . . . . 0.0 109.249 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.446 ' HB3' HG23 ' A' ' 82' ' ' THR . 0.2 OUTLIER -58.33 -53.56 56.88 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.377 -0.827 . . . . 0.0 110.466 -179.667 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.47 ' HA ' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.87 -40.55 89.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.28 -0.887 . . . . 0.0 108.611 -179.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.516 ' OE2' ' CA ' ' B' ' 62' ' ' ASN . 0.3 OUTLIER -76.48 -12.07 59.98 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.442 -0.786 . . . . 0.0 109.083 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.556 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 8.5 t80 -73.26 -57.99 3.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.523 ' CG ' ' HG2' ' A' ' 74' ' ' MET . 0.0 OUTLIER -59.51 -45.72 90.91 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.102 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.452 ' O ' ' SD ' ' B' ' 79' ' ' MET . . . -60.02 -33.18 71.65 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.353 -0.842 . . . . 0.0 108.784 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.631 ' CE1' ' CG2' ' B' ' 56' ' ' VAL . 1.0 OUTLIER -57.26 -70.03 0.14 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.014 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.515 ' CG1' ' HG3' ' B' ' 39' ' ' GLU . 6.7 t -50.22 -32.34 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.468 -0.77 . . . . 0.0 109.31 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.536 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -58.98 -45.55 90.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 109.867 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 2.7 mpp? -76.46 -68.4 0.6 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.197 -0.94 . . . . 0.0 109.825 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.585 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -45.29 -24.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.452 -1.405 . . . . 0.0 109.441 -179.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.504 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 8.5 m -77.7 -68.1 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.051 -1.031 . . . . 0.0 108.916 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -79.08 -49.65 12.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 108.798 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.574 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.69 -37.43 0.22 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.742 -0.599 . . . . 0.0 109.789 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 43.3 t -72.96 -48.31 37.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.3 -0.875 . . . . 0.0 109.47 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.66 -10.06 32.86 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.243 -0.911 . . . . 0.0 109.473 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -38.52 69.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 0.0 109.411 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.82 -32.55 63.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.305 -0.872 . . . . 0.0 109.442 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.494 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 0.3 OUTLIER -57.62 -40.46 79.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.439 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.494 ' CB ' ' O ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER 76.58 -79.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.55 -161.74 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.194 -0.941 . . . . 0.0 109.456 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.484 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 29.6 t . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.371 0.605 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.32 -70.67 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 109.913 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.525 ' CD2' ' OE2' ' B' ' 39' ' ' GLU . 6.0 mt -78.51 -33.13 48.3 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.118 -0.989 . . . . 0.0 110.02 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.465 ' O ' ' HB3' ' A' ' 7' ' ' MET . 11.5 tt0 -57.77 -59.97 4.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.086 -1.008 . . . . 0.0 109.246 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.17 -53.21 59.86 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.347 -0.845 . . . . 0.0 109.469 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.52 ' HB3' ' CB ' ' B' ' 6' ' ' ALA . . . -61.24 -12.84 14.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.295 -0.878 . . . . 0.0 109.671 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.526 ' O ' ' CD1' ' A' ' 11' ' ' ILE . 4.9 ttp -80.29 -60.43 2.33 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.172 -0.955 . . . . 0.0 109.435 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 4.2 t -55.01 -27.89 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.482 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -77.82 -64.31 1.18 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.63 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.518 ' CD1' ' HB2' ' B' ' 6' ' ' ALA . 0.2 OUTLIER -43.3 -53.4 5.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 0.0 109.754 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.526 ' CD1' ' O ' ' A' ' 7' ' ' MET . 2.1 mp -59.24 -45.88 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.275 -0.891 . . . . 0.0 109.583 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 0.5 OUTLIER -55.74 -23.48 29.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.195 -0.941 . . . . 0.0 109.413 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.564 ' CG1' ' CD2' ' A' ' 35' ' ' LEU . 1.2 t -89.13 -27.09 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.259 -0.901 . . . . 0.0 109.231 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.576 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 10.3 t80 -64.67 -42.4 95.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.012 -1.055 . . . . 0.0 109.057 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.568 ' CE1' ' CE1' ' A' ' 25' ' ' HIS . 3.8 m-70 -82.4 -44.37 16.18 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.325 -0.859 . . . . 0.0 109.518 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -52.8 -59.44 4.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.495 ' CD1' HG12 ' A' ' 13' ' ' VAL . 34.6 m-85 -61.85 -45.76 92.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.891 . . . . 0.0 109.616 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.517 ' OG ' ' CD1' ' A' ' 27' ' ' LEU . 48.2 m -72.26 -3.08 21.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.772 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 15' ' ' HIS . . . -75.1 -9.16 83.95 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.44 ' HD3' ' OE2' ' A' ' 31' ' ' GLU . 16.9 mtt85 -87.93 -34.68 18.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.305 -1.115 . . . . 0.0 109.462 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 8.9 tt0 -69.94 154.4 42.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.299 -0.876 . . . . 0.0 109.381 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -43.49 -26.94 0.73 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.465 ' OD2' ' HD3' ' A' ' 26' ' ' LYS . 37.1 t70 -112.34 135.62 52.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 18' ' ' SER . 6.4 ptmt -91.99 70.91 5.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.287 -0.883 . . . . 0.0 109.571 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.576 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -170.2 -34.79 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -118.75 151.05 38.74 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.975 . . . . 0.0 109.785 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.545 ' CD2' ' CD1' ' A' ' 35' ' ' LEU . 7.2 mp -89.77 165.92 13.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.232 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 10.4 pttp -122.47 69.94 0.98 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.203 -0.935 . . . . 0.0 109.634 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.495 ' HG2' ' N ' ' A' ' 30' ' ' SER . 0.3 OUTLIER 62.18 -84.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.453 -0.779 . . . . 0.0 110.339 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.495 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 7.9 t -46.1 -42.22 13.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.169 -0.957 . . . . 0.0 110.445 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 67.5 mm-40 -56.77 -42.46 79.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.906 -1.121 . . . . 0.0 109.146 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.533 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 33.1 mt -60.15 -65.53 0.67 Allowed 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.511 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 2.4 ttpp -40.8 -29.61 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.369 -0.832 . . . . 0.0 109.52 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -66.81 -58.1 5.72 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.322 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.564 ' CD2' ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.8 -29.08 17.66 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.36 -0.837 . . . . 0.0 109.569 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.576 HD12 ' CE1' ' A' ' 76' ' ' PHE . 3.0 mp -74.46 -40.02 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.148 -0.97 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.511 ' ND2' ' HG3' ' A' ' 33' ' ' LYS . 73.2 m-80 -90.19 6.1 44.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 109.689 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.71 -37.58 5.63 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 109.414 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.485 ' HG2' ' N ' ' A' ' 40' ' ' LEU . 1.9 pt-20 -111.76 -25.82 9.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.315 -0.866 . . . . 0.0 109.327 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.531 ' HB3' ' CD2' ' A' ' 44' ' ' LEU . 89.2 mt -108.28 69.44 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.29 7.44 8.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -130.8 0.01 4.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.219 -0.926 . . . . 0.0 109.643 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.64 -54.93 2.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.158 -0.964 . . . . 0.0 109.486 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.531 ' CD2' ' HB3' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -100.22 25.97 7.0 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.25 -0.906 . . . . 0.0 109.426 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 47' ' ' ILE . 1.4 mt-10 43.1 71.8 0.21 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.307 -0.871 . . . . 0.0 109.581 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 52.38 -90.17 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.882 . . . . 0.0 109.255 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.552 ' O ' ' CG ' ' A' ' 48' ' ' LYS . 5.5 mm -133.15 -39.96 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.283 -0.885 . . . . 0.0 109.332 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 85.53 -32.15 0.05 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.814 -0.554 . . . . 0.0 109.767 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 3.2 mt-10 162.52 64.7 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.193 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.2 OUTLIER 33.45 48.35 0.18 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.247 0.546 . . . . 0.0 110.045 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' C ' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -90.05 -62.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.347 -0.846 . . . . 0.0 109.772 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.537 ' HB ' ' CG1' ' A' ' 80' ' ' VAL . 1.6 t -88.35 -14.33 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.072 -1.017 . . . . 0.0 109.92 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.518 ' CG2' HD13 ' A' ' 47' ' ' ILE . 27.4 t -84.01 -28.43 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.832 -1.167 . . . . 0.0 108.68 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.69 -33.23 20.11 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.27 -0.894 . . . . 0.0 108.773 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -51.43 7.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.82 . . . . 0.0 108.974 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 0.9 OUTLIER -60.62 -41.87 89.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 O-C-N 121.159 -0.963 . . . . 0.0 108.896 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.533 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 7.1 tpt -42.01 -50.02 4.64 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.595 -0.69 . . . . 0.0 109.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -43.85 88.28 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.233 -0.917 . . . . 0.0 108.942 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.475 HG23 ' CE ' ' A' ' 79' ' ' MET . 15.8 m -62.23 -23.8 66.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.359 -0.838 . . . . 0.0 109.652 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -85.66 -27.43 25.38 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.13 -0.981 . . . . 0.0 109.275 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.472 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 82.2 m-20 -63.41 114.08 3.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.224 -0.922 . . . . 0.0 109.51 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -47.95 -43.08 28.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 109.425 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.99 25.82 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.441 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.16 88.84 2.04 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.11 -34.43 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.2 -1.177 . . . . 0.0 108.622 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 27' ' ' LEU . . . 110.1 -19.02 27.96 Favored Glycine 0 N--CA 1.485 1.947 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.402 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 26.8 mt-10 -73.11 97.4 2.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 109.541 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 12.9 t -69.79 154.28 42.18 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.198 -0.939 . . . . 0.0 109.619 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.457 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -113.32 171.33 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.806 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.464 ' HB3' HG22 ' B' ' 82' ' ' THR . 0.1 OUTLIER -61.39 -50.13 74.11 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.229 -0.919 . . . . 0.0 110.091 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.521 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 4.4 mp0 -54.83 -40.05 69.2 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.316 -0.865 . . . . 0.0 109.145 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.476 ' HB3' ' HA ' ' A' ' 60' ' ' LEU . 2.4 mt-10 -79.69 -17.82 52.74 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.306 -0.871 . . . . 0.0 109.663 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.571 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 22.1 t80 -69.56 -54.72 12.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.07 -1.019 . . . . 0.0 108.84 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.528 ' HG2' ' CG ' ' B' ' 74' ' ' MET . 1.6 ttm -64.42 -44.4 91.35 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.278 -0.889 . . . . 0.0 108.787 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' ' CE ' ' A' ' 79' ' ' MET . . . -64.04 -25.11 67.97 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.303 -0.873 . . . . 0.0 108.817 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.576 ' CE1' HD12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -64.09 -65.72 0.64 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.569 HG21 ' CE2' ' A' ' 76' ' ' PHE . 39.9 t -61.31 -22.14 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.885 . . . . 0.0 108.95 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.544 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -66.42 -40.97 89.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.365 -0.834 . . . . 0.0 109.341 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.567 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 49.3 mtm -78.02 -66.26 0.87 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.281 -0.887 . . . . 0.0 109.42 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.537 ' CG1' ' HB ' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.48 -22.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 O-C-N 120.474 -1.391 . . . . 0.0 109.462 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.495 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 6.2 m -80.67 -68.0 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.002 -1.061 . . . . 0.0 109.096 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.557 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.4 t -75.94 -49.33 18.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.0 109.089 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.567 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -36.52 -40.89 0.27 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.707 -0.621 . . . . 0.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.4 t -77.4 -42.57 35.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -0.906 . . . . 0.0 109.523 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 82' ' ' THR . 21.8 t-160 -64.44 -11.0 28.85 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.219 -0.926 . . . . 0.0 109.522 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -39.04 21.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.286 -0.884 . . . . 0.0 109.504 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -54.24 -51.41 64.58 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.256 -0.903 . . . . 0.0 109.502 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -24.33 67.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.185 -0.947 . . . . 0.0 109.475 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -49.61 56.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.244 -0.91 . . . . 0.0 109.489 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -179.68 4.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.283 -0.885 . . . . 0.0 109.51 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.97 -1.014 . . . . 0.0 109.453 -179.984 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.507 ' CB ' HG22 ' A' ' 13' ' ' VAL . 2.1 mp0 -72.74 -69.26 0.42 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.423 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.533 ' N ' ' CD1' ' B' ' 3' ' ' LEU . 6.2 mp -65.39 -11.16 39.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.905 . . . . 0.0 109.468 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.501 ' O ' ' CG2' ' B' ' 8' ' ' VAL . 30.9 tt0 -73.83 -62.58 1.45 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.219 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -65.39 -36.55 84.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.268 -0.895 . . . . 0.0 109.135 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' A' ' 6' ' ' ALA . . . -64.27 -66.46 0.54 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.308 -0.87 . . . . 0.0 109.433 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.465 ' O ' HG12 ' B' ' 11' ' ' ILE . 0.4 OUTLIER -45.3 -30.81 1.36 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.309 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.501 ' CG2' ' O ' ' B' ' 4' ' ' GLU . 79.6 t -60.64 -55.61 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.122 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -44.92 87.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.177 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.439 HD13 HD22 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -58.76 -26.44 64.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.312 -0.868 . . . . 0.0 109.34 179.824 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.514 HD12 ' CZ ' ' B' ' 70' ' ' PHE . 9.0 mm -70.08 -48.29 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.267 -0.895 . . . . 0.0 109.108 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.469 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.8 OUTLIER -65.43 -19.03 65.77 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.49 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.456 HG12 HD13 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -88.22 -30.85 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.227 -0.92 . . . . 0.0 109.338 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 18.8 t80 -67.91 -46.07 72.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.02 -1.05 . . . . 0.0 109.214 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.437 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 53.6 m170 -79.53 -34.24 41.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.242 -0.911 . . . . 0.0 109.64 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.469 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -62.7 -61.75 2.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 109.455 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.626 ' CG ' ' CD2' ' B' ' 35' ' ' LEU . 35.9 m-85 -58.19 -44.58 88.14 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.233 -0.917 . . . . 0.0 109.614 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 83.4 p -67.0 -18.88 65.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.565 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.85 13.73 66.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.07 -38.24 13.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -1.158 . . . . 0.0 109.435 179.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -166.05 140.36 4.46 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 109.468 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 23' ' ' ASP . . . 84.28 -149.39 24.95 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.452 ' O ' ' O ' ' B' ' 18' ' ' SER . 4.0 p30 -54.75 -169.55 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.8 ptpt -134.12 11.85 3.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -138.27 7.15 2.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 109.595 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.514 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -143.07 170.14 16.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.557 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 4.2 mp -121.96 139.26 53.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.165 -0.959 . . . . 0.0 110.3 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.521 ' O ' ' N ' ' B' ' 30' ' ' SER . 14.7 tttm -86.18 156.95 20.11 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.504 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 11.8 mttt -37.46 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.062 -1.023 . . . . 0.0 109.987 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.521 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.5 OUTLIER -79.0 -45.95 19.19 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.557 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.2 OUTLIER -58.47 -40.26 82.22 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 120.808 -1.182 . . . . 0.0 108.776 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.523 HD23 ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -59.12 -63.4 1.32 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.523 ' CG ' HG13 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -39.97 -44.21 1.67 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.514 -0.741 . . . . 0.0 109.871 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.46 -61.04 2.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.626 ' CD2' ' CG ' ' B' ' 17' ' ' TYR . 2.4 mm? -49.29 -58.56 4.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -0.864 . . . . 0.0 109.804 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.596 HG12 ' CE1' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -43.23 -35.34 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.31 -0.869 . . . . 0.0 109.739 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.474 ' HA ' ' HA ' ' B' ' 43' ' ' PHE . 22.6 m120 -73.67 -54.8 7.28 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 110.142 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' B' ' 38' ' ' ASN . 1.5 m120 -96.29 27.59 3.66 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.171 -0.956 . . . . 0.0 109.579 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CD2' ' A' ' 3' ' ' LEU . 21.5 tt0 -127.79 -37.79 1.92 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.236 -0.915 . . . . 0.0 109.321 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.3 mm? -73.02 -56.26 5.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.313 -0.867 . . . . 0.0 109.285 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 5.4 t 161.34 -56.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.499 -0.75 . . . . 0.0 108.978 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.551 ' C ' ' CG ' ' B' ' 43' ' ' PHE . 2.6 p80 -138.43 56.14 1.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.551 ' CG ' ' C ' ' B' ' 42' ' ' HIS . 0.6 OUTLIER 40.43 34.81 0.25 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.551 -0.718 . . . . 0.0 109.555 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' B' ' 44' ' ' LEU . 1.3 mp 44.45 -156.85 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.31 -0.868 . . . . 0.0 109.202 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.31 57.89 4.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.308 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 0.4 OUTLIER 66.74 25.74 9.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.283 -0.886 . . . . 0.0 109.048 -179.718 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.535 ' CG2' ' O ' ' B' ' 47' ' ' ILE . 23.3 mm 62.58 12.18 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.432 -0.793 . . . . 0.0 109.561 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.481 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 42.98 26.2 0.07 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.08 -1.012 . . . . 0.0 109.577 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.481 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.4 tt0 75.02 87.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.115 -0.991 . . . . 0.0 109.83 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.49 ' N ' HG23 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 42.39 50.66 4.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.322 -0.861 . . . . 0.0 109.839 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.457 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 5.5 tp10 -91.2 -70.57 0.68 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.174 -0.954 . . . . 0.0 109.705 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.533 ' CG1' ' CG1' ' B' ' 80' ' ' VAL . 2.0 t -91.51 -15.04 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.182 -0.949 . . . . 0.0 109.38 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.523 HG13 ' CG ' ' B' ' 33' ' ' LYS . 62.3 t -84.28 -30.01 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 120.966 -1.084 . . . . 0.0 108.594 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 10.1 t0 -90.18 -29.08 18.47 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.308 -0.87 . . . . 0.0 108.873 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 10.5 mtmt -85.27 -47.93 9.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.392 -0.817 . . . . 0.0 109.23 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 0.6 OUTLIER -65.66 -40.67 88.61 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.124 -0.985 . . . . 0.0 109.006 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.52 ' SD ' ' CD1' ' B' ' 32' ' ' LEU . 8.0 tpt -39.9 -52.53 2.39 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.763 -0.586 . . . . 0.0 109.723 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.73 -42.27 96.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.196 -0.94 . . . . 0.0 108.863 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.418 ' O ' HG21 ' B' ' 59' ' ' THR . 96.6 m -62.22 -20.51 64.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.363 -0.836 . . . . 0.0 109.799 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.537 ' CD2' ' HB2' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -85.33 -73.62 0.43 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.041 -1.037 . . . . 0.0 109.189 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.453 ' HA ' ' OE1' ' B' ' 72' ' ' GLU . 9.8 t70 -84.64 93.12 8.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.28 -0.888 . . . . 0.0 109.547 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.29 10.74 40.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.907 . . . . 0.0 109.369 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -92.43 -41.84 10.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 109.558 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 90.05 2.1 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -172.87 -37.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.293 -1.122 . . . . 0.0 108.463 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 32.88 3.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.514 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 5.2 mt-10 -144.9 113.11 6.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.255 -1.144 . . . . 0.0 109.361 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.518 ' SG ' ' CD2' ' B' ' 32' ' ' LEU . 12.8 m -69.86 151.18 46.0 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.202 -0.936 . . . . 0.0 109.904 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.474 ' HB3' ' HG3' ' B' ' 72' ' ' GLU . 4.5 t70 -112.46 171.29 7.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -0.856 . . . . 0.0 108.724 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.36 -53.0 59.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.225 -0.922 . . . . 0.0 110.491 -179.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.425 ' OE1' ' OD2' ' B' ' 69' ' ' ASP . 0.0 OUTLIER -56.61 -26.65 56.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.151 -0.968 . . . . 0.0 109.269 -179.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.474 ' HG3' ' HB3' ' B' ' 69' ' ' ASP . 6.5 mt-10 -85.58 -22.66 27.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 109.831 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.531 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 50.8 t80 -74.28 -40.41 62.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.09 -1.006 . . . . 0.0 108.943 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.544 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -75.6 -41.12 55.33 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.48 -0.762 . . . . 0.0 109.196 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.95 71.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.15 -0.969 . . . . 0.0 108.861 179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.596 ' CE1' HG12 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -66.08 -63.37 1.1 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.449 -0.782 . . . . 0.0 108.944 179.691 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.578 HG21 ' CD2' ' B' ' 76' ' ' PHE . 52.2 t -57.83 -26.78 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.189 -0.944 . . . . 0.0 109.351 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.521 ' CB ' ' HA ' ' A' ' 71' ' ' GLN . . . -67.09 -34.49 77.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.345 -0.847 . . . . 0.0 109.472 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 0.3 OUTLIER -82.86 -69.4 0.63 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 109.659 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.533 ' CG1' ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.88 -23.78 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.549 -1.345 . . . . 0.0 109.334 -179.413 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 12.0 m -78.42 -67.74 0.71 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.561 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -78.22 -49.54 13.57 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.136 -0.977 . . . . 0.0 108.874 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.561 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.83 -36.38 0.11 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.769 -0.582 . . . . 0.0 109.82 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.3 t -90.03 -36.94 14.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.202 -0.936 . . . . 0.0 109.438 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.509 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 60.3 t60 -62.33 -12.95 23.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.95 -31.3 23.66 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.2 -0.938 . . . . 0.0 109.406 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -55.34 5.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -90.05 -43.98 10.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.271 -0.893 . . . . 0.0 109.511 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' B' ' 85' ' ' HIS . 2.6 tm-20 -60.02 131.46 50.93 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.235 -0.915 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.424 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 7.6 t60 69.37 124.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.458 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.421 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 16.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.31 -77.54 0.11 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.457 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.526 ' HB2' ' CG ' ' B' ' 39' ' ' GLU . 7.3 mp -66.91 -15.53 63.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.447 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.571 ' HG3' ' CD2' ' B' ' 42' ' ' HIS . 0.1 OUTLIER -73.65 -63.02 1.29 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.378 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HD2' ' O ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -63.08 -34.18 77.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.249 -0.907 . . . . 0.0 109.356 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' B' ' 6' ' ' ALA . . . -66.44 -66.92 0.49 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 0.0 109.549 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.525 ' O ' ' CD1' ' A' ' 11' ' ' ILE . 6.8 ptm -43.93 -31.78 0.96 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.4 -55.65 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.513 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' B' ' 2' ' ' GLU . . . -63.42 -57.72 9.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.504 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.627 ' CD2' ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -44.04 -37.96 3.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 109.372 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.525 ' CD1' ' O ' ' A' ' 7' ' ' MET . 32.9 mt -64.64 -45.8 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.937 . . . . 0.0 109.36 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -58.27 -23.68 56.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.282 -0.886 . . . . 0.0 109.302 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.611 ' CG1' ' CZ ' ' A' ' 73' ' ' PHE . 0.9 OUTLIER -83.47 -38.6 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.264 -0.898 . . . . 0.0 109.398 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 9.0 t80 -59.56 -51.96 67.58 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 120.92 -1.112 . . . . 0.0 109.425 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -55.16 14.88 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.562 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -46.09 -69.47 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.221 -0.924 . . . . 0.0 109.605 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.572 ' CE1' ' HG ' ' A' ' 35' ' ' LEU . 41.3 m-85 -50.2 -27.67 6.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.248 -0.908 . . . . 0.0 109.561 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.484 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -62.52 -44.9 95.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 109.427 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.523 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -55.27 -18.52 14.05 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 27.8 mmm180 -68.14 -41.87 81.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.308 -1.113 . . . . 0.0 109.419 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.568 ' CG ' ' CD ' ' A' ' 28' ' ' LYS . 2.7 tm-20 -82.23 161.24 22.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.318 -0.864 . . . . 0.0 109.433 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -45.52 -51.04 10.11 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -94.97 167.33 11.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.232 -1.158 . . . . 0.0 109.402 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 11.4 mttt -118.13 86.96 2.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.294 -0.879 . . . . 0.0 109.522 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.9 t-80 -170.08 -35.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.911 . . . . 0.0 109.624 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 5.7 mtmt -140.05 170.11 16.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.504 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 82.5 mt -107.05 170.09 8.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.284 -0.885 . . . . 0.0 109.497 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.568 ' CD ' ' CG ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -128.97 73.59 1.52 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.141 -0.974 . . . . 0.0 109.917 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 5.6 ttmt 62.35 -84.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.442 -0.786 . . . . 0.0 110.696 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.465 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.8 OUTLIER -43.81 -50.53 7.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.115 -0.991 . . . . 0.0 110.567 -179.058 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 6.1 mm-40 -52.69 -40.89 63.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.972 -1.08 . . . . 0.0 109.513 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.572 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 14.2 mt -58.92 -65.89 0.59 Allowed 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.623 -0.673 . . . . 0.0 109.631 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.52 ' CA ' HG13 ' A' ' 36' ' ' ILE . 7.1 ttpp -38.47 -37.64 0.32 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.578 -0.701 . . . . 0.0 110.016 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.448 ' O ' ' OD1' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -65.9 -50.29 65.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -0.939 . . . . 0.0 109.474 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HG ' ' CE1' ' A' ' 17' ' ' TYR . 1.3 mt -60.93 -21.53 63.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 0.0 109.783 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.585 HG12 ' CE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -78.25 -57.97 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.166 -0.959 . . . . 0.0 109.575 -179.75 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 42' ' ' HIS . 70.3 m-80 -70.1 -5.18 25.1 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.19 -0.944 . . . . 0.0 109.67 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 34' ' ' GLU . 6.5 m120 -114.39 -8.75 12.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.186 -0.946 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.559 ' CG ' ' CB ' ' B' ' 3' ' ' LEU . 1.8 tm-20 -94.25 -46.91 6.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.175 -0.953 . . . . 0.0 109.584 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.531 ' HG ' ' CD2' ' A' ' 44' ' ' LEU . 2.9 mm? -72.9 -52.35 15.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.215 -0.928 . . . . 0.0 109.555 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.428 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER 170.08 -60.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.155 -0.965 . . . . 0.0 109.656 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.467 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 68.6 m-70 -136.1 -57.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.192 -0.943 . . . . 0.0 109.459 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.499 ' C ' ' CD1' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -160.16 28.78 0.17 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.285 -0.885 . . . . 0.0 109.493 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.579 ' CD1' ' N ' ' A' ' 44' ' ' LEU . 0.9 OUTLIER 46.39 -148.33 0.13 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 109.377 179.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -48.68 -49.32 38.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.228 -0.92 . . . . 0.0 109.265 179.804 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.468 ' HB3' ' O ' ' A' ' 45' ' ' GLU . 6.3 pt-20 167.78 88.18 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.6 ' CG2' ' CG2' ' A' ' 53' ' ' VAL . 6.1 mt -82.05 72.37 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.271 -0.893 . . . . 0.0 109.238 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -42.5 -34.79 0.9 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.355 -0.841 . . . . 0.0 109.444 179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HB3' ' O ' ' A' ' 48' ' ' LYS . 14.1 pt-20 178.37 -31.72 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.449 -0.782 . . . . 0.0 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 1.2 pt20 -159.72 29.98 0.19 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.266 -0.896 . . . . 0.0 109.759 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.453 ' OE1' ' HG3' ' A' ' 46' ' ' GLU . 1.8 mt-10 -60.79 -70.86 0.16 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.033 -1.042 . . . . 0.0 108.802 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.528 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 2.5 t -90.96 -12.72 9.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.6 ' CG2' ' CG2' ' A' ' 47' ' ' ILE . 0.7 OUTLIER -76.91 -30.27 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.451 ' HB2' ' HB2' ' A' ' 50' ' ' GLN . 22.6 t70 -76.24 -47.18 24.85 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.278 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -50.54 63.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.296 -0.878 . . . . 0.0 109.394 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.528 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 24.0 m -57.78 -47.31 86.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.114 -0.991 . . . . 0.0 109.58 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.572 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 9.9 tpt -38.21 -49.55 1.37 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.576 -0.702 . . . . 0.0 110.349 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -60.02 -46.1 90.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.12 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.438 HG21 ' O ' ' A' ' 59' ' ' THR . 28.6 m -73.18 -8.76 57.21 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.443 -0.786 . . . . 0.0 109.856 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 56' ' ' VAL . 1.9 mt -84.78 -27.68 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.166 -0.959 . . . . 0.0 109.324 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -43.73 110.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.537 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.521 ' CB ' ' OD1' ' A' ' 69' ' ' ASP . 33.2 t30 -60.1 -52.05 67.0 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.3 -0.875 . . . . 0.0 109.42 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -152.57 18.12 0.62 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.224 -0.922 . . . . 0.0 109.519 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.79 88.53 1.77 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.28 -36.66 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.301 -1.117 . . . . 0.0 108.525 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.2 -1.23 31.26 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -99.83 121.7 41.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.213 -1.169 . . . . 0.0 109.483 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -69.51 131.28 44.47 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.521 ' OD1' ' CB ' ' A' ' 62' ' ' ASN . 2.2 m-20 -110.27 170.66 7.93 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.579 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 1.2 t80 -52.96 -50.63 63.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.071 -1.018 . . . . 0.0 110.406 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.478 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 10.2 mt-30 -51.92 -46.48 64.66 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.501 -0.749 . . . . 0.0 109.752 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.496 ' OE1' HD21 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -74.38 -18.6 60.65 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.095 -1.003 . . . . 0.0 109.695 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.627 ' CE2' ' CD2' ' A' ' 10' ' ' LEU . 10.5 t80 -63.17 -53.95 45.31 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.045 -1.034 . . . . 0.0 109.235 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.54 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.69 -46.21 66.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.528 ' HB1' ' CB ' ' B' ' 75' ' ' ALA . . . -56.18 -31.54 63.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.038 -1.039 . . . . 0.0 109.04 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.585 ' CE1' HG12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -64.6 -65.05 0.73 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.549 ' CG2' ' CE2' ' A' ' 76' ' ' PHE . 41.3 t -56.55 -18.71 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.532 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -65.46 -48.92 71.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.353 -0.842 . . . . 0.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.568 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 0.9 OUTLIER -74.98 -64.16 1.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.354 -0.841 . . . . 0.0 109.745 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.557 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -48.01 -22.01 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 O-C-N 120.407 -1.433 . . . . 0.0 109.627 -178.824 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.502 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 4.6 m -80.62 -65.8 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.91 -1.119 . . . . 0.0 108.876 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.7 t -80.1 -49.7 11.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.158 -0.963 . . . . 0.0 108.922 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.573 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -37.68 -33.77 0.08 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.607 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.458 ' SG ' ' HG2' ' A' ' 45' ' ' GLU . 11.9 t -74.17 -50.89 17.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.354 -0.841 . . . . 0.0 109.351 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -53.44 -55.69 23.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.922 . . . . 0.0 109.45 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -38.55 83.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 0.0 109.471 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -44.64 -33.36 1.78 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.63 -40.69 48.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.229 -0.92 . . . . 0.0 109.533 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.22 161.52 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.921 . . . . 0.0 109.483 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 -131.56 175.91 8.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 109.502 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.429 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -58.25 -75.13 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.254 -0.903 . . . . 0.0 109.66 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.559 ' CB ' ' CG ' ' A' ' 39' ' ' GLU . 1.3 mt -75.58 -30.6 59.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 0.0 109.651 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 7' ' ' MET . 16.9 mt-10 -57.36 -59.1 5.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -0.954 . . . . 0.0 109.301 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' B' ' 1' ' ' SER . 1.0 OUTLIER -60.71 -49.66 76.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.291 -0.881 . . . . 0.0 109.378 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 6' ' ' ALA . . . -66.0 -9.83 33.99 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.274 -0.891 . . . . 0.0 109.449 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' B' ' 3' ' ' LEU . 2.6 ttp -80.71 -53.84 6.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.436 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.97 -36.44 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.373 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.12 -46.72 64.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.203 -0.936 . . . . 0.0 109.469 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.498 ' HB3' ' CE ' ' B' ' 74' ' ' MET . 6.3 mt -61.3 -66.84 0.47 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.903 . . . . 0.0 109.427 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.447 HD13 ' HG3' ' B' ' 7' ' ' MET . 61.3 mt -41.76 -40.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.402 -0.811 . . . . 0.0 109.327 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 29.7 t70 -58.59 -54.06 51.37 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.26 -0.9 . . . . 0.0 109.066 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.536 HG11 ' CE1' ' B' ' 73' ' ' PHE . 1.7 t -51.5 -25.94 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.375 -0.828 . . . . 0.0 109.504 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 10.0 t80 -72.08 -46.39 57.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.897 -1.127 . . . . 0.0 109.666 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.506 ' NE2' ' HD3' ' B' ' 24' ' ' LYS . 43.9 t-80 -78.04 -14.68 59.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.262 -0.899 . . . . 0.0 110.454 -179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.525 ' O ' ' CG ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -90.41 -60.16 2.0 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.947 -1.096 . . . . 0.0 109.287 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.579 ' CD2' ' OE1' ' B' ' 34' ' ' GLU . 24.6 m-85 -61.63 -33.23 73.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.522 -0.736 . . . . 0.0 109.623 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.52 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 4.2 p -82.87 -11.35 58.28 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.172 -0.955 . . . . 0.0 109.658 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.445 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -102.77 9.31 55.26 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.525 ' CG ' ' O ' ' B' ' 16' ' ' GLN . 11.0 mtp85 -89.98 -33.95 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -1.159 . . . . 0.0 109.476 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.468 ' HB2' ' HD3' ' B' ' 28' ' ' LYS . 5.6 pt-20 -170.17 117.44 0.55 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.905 . . . . 0.0 109.384 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.54 -81.13 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' B' ' 24' ' ' LYS . 3.2 p30 -171.57 28.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -1.147 . . . . 0.0 109.555 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.506 ' HD3' ' NE2' ' B' ' 15' ' ' HIS . 1.6 ttmt 43.65 61.2 2.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.893 . . . . 0.0 109.508 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.5 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.2 OUTLIER -170.1 -34.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 0.0 109.678 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -141.12 165.25 28.05 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.203 -0.935 . . . . 0.0 109.708 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.543 ' CD1' ' CD2' ' B' ' 32' ' ' LEU . 17.8 mt -87.77 148.76 24.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.303 -0.873 . . . . 0.0 109.262 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -116.55 72.64 0.82 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.688 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.463 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 62.32 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.461 -0.775 . . . . 0.0 110.578 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.455 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 0.3 OUTLIER -48.32 -37.52 16.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.197 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' B' ' 34' ' ' GLU . 66.9 mm-40 -58.27 -41.22 83.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.085 -1.009 . . . . 0.0 109.48 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.543 ' CD2' ' CD1' ' B' ' 27' ' ' LEU . 18.8 mt -64.46 -57.13 10.11 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.524 -0.735 . . . . 0.0 109.496 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.583 ' CD ' ' CG1' ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.89 -68.78 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.252 -0.905 . . . . 0.0 110.055 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.579 ' OE1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -42.74 -49.82 5.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 109.779 -179.421 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.571 HD11 ' CZ ' ' B' ' 17' ' ' TYR . 14.1 tp -49.12 -47.54 45.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.004 -1.06 . . . . 0.0 109.555 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.531 ' O ' ' CB ' ' B' ' 40' ' ' LEU . 2.9 mt -63.84 -32.66 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' GLU . 9.2 m120 -94.46 -77.33 0.46 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.05 . . . . 0.0 109.731 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.418 ' C ' ' O ' ' B' ' 37' ' ' ASN . 5.0 t-20 -42.68 -26.42 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.329 -0.857 . . . . 0.0 109.902 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.526 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -109.31 -46.24 3.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.084 -1.01 . . . . 0.0 109.922 -179.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.531 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 0.7 OUTLIER -104.89 61.65 0.7 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.065 -1.022 . . . . 0.0 109.503 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.2 30.01 7.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.571 ' CD2' ' HG3' ' A' ' 4' ' ' GLU . 86.4 m-70 -109.82 -72.03 0.74 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.458 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.47 ' O ' ' CG ' ' B' ' 43' ' ' PHE . 68.6 t80 -86.11 -5.83 59.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.198 -0.939 . . . . 0.0 109.583 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.528 HD12 ' CD2' ' B' ' 40' ' ' LEU . 5.8 mp -102.17 92.91 4.95 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.27 -0.894 . . . . 0.0 109.441 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -57.0 89.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.224 -0.923 . . . . 0.0 109.463 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER 45.4 -170.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.183 -0.948 . . . . 0.0 109.406 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.566 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 29.7 mt -98.43 -19.04 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.215 -0.928 . . . . 0.0 109.443 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 83.1 -42.73 0.1 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.686 -0.634 . . . . 0.0 109.725 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.0 OUTLIER 179.55 -44.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.139 -0.976 . . . . 0.0 109.203 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.6 OUTLIER 162.36 58.52 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.362 -0.836 . . . . 0.0 109.243 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -90.42 -70.35 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.201 -0.937 . . . . 0.0 109.899 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.546 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.7 t -87.64 -20.89 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.094 -1.004 . . . . 0.0 109.601 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.583 ' CG1' ' CD ' ' B' ' 33' ' ' LYS . 54.7 t -76.9 -29.59 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.955 -1.091 . . . . 0.0 109.224 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.3 OUTLIER -90.11 -29.55 18.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.259 -0.901 . . . . 0.0 109.546 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -35.18 35.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.632 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.546 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 11.1 m -58.63 -47.08 89.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 O-C-N 121.13 -0.981 . . . . 0.0 109.919 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.517 ' HE3' ' CD1' ' B' ' 32' ' ' LEU . 8.2 tpp -42.01 -28.33 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.014 -1.054 . . . . 0.0 109.14 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 1.7 mp0 -80.71 -45.39 17.19 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.457 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.6 m -73.53 -67.21 0.61 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.405 -0.809 . . . . 0.0 109.39 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.574 HD12 ' CD1' ' B' ' 76' ' ' PHE . 2.6 mt -40.61 -33.87 0.31 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.481 -0.762 . . . . 0.0 109.341 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 57' ' ' MET . 4.7 t0 -90.17 83.95 6.06 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.419 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -96.1 26.92 3.9 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.266 -0.896 . . . . 0.0 109.577 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . 0.448 ' OD2' ' OD2' ' B' ' 69' ' ' ASP . 13.1 m-20 -127.93 -34.17 2.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 109.5 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.15 91.47 1.34 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 177.04 -32.71 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.219 -1.165 . . . . 0.0 108.669 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.13 26.49 4.9 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.478 ' HB2' ' CG ' ' B' ' 26' ' ' LYS . 23.8 pt-20 -136.43 124.46 22.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.236 -1.155 . . . . 0.0 109.374 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.529 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 12.8 m -69.57 166.05 19.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.188 -0.945 . . . . 0.0 110.009 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.453 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.6 OUTLIER -129.21 172.23 11.66 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.549 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -61.27 -52.66 63.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.489 -179.555 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.452 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 0.8 OUTLIER -56.34 -34.77 66.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.133 -0.98 . . . . 0.0 109.225 -179.588 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.535 ' OE1' ' CA ' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -81.49 -20.2 40.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 108.877 179.561 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.565 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 3.9 t80 -65.7 -51.04 62.53 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.532 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -69.11 -46.15 68.41 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.279 -0.888 . . . . 0.0 108.902 179.503 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.528 ' CB ' ' HB1' ' A' ' 75' ' ' ALA . . . -64.74 -18.13 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.171 -0.956 . . . . 0.0 108.87 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.574 ' CD1' HD12 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -72.62 -62.78 1.33 Allowed 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.521 ' O ' ' CG2' ' B' ' 81' ' ' THR . 96.1 t -60.56 -27.58 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.54 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -69.26 -30.58 68.73 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.584 -0.697 . . . . 0.0 109.229 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 2.4 mmm -76.28 -71.05 0.41 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.17 -0.956 . . . . 0.0 108.643 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.528 HG11 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.6 -24.99 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 O-C-N 120.66 -1.275 . . . . 0.0 109.467 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.521 ' CG2' ' O ' ' B' ' 77' ' ' VAL . 4.9 p -75.38 -69.61 0.47 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 0.0 108.547 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.2 m -78.01 -53.6 7.24 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -35.96 -37.04 0.1 Allowed 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.257 0.551 . . . . 0.0 109.851 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' B' ' 82' ' ' THR . 5.2 t -88.2 -38.68 15.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.272 -0.892 . . . . 0.0 109.533 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' B' ' 82' ' ' THR . 3.2 t-160 -55.41 -21.23 14.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.479 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -87.59 -37.93 16.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.923 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.0 -20.29 3.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.47 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.15 -69.88 0.1 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.221 -0.924 . . . . 0.0 109.41 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.84 122.97 10.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.279 -0.888 . . . . 0.0 109.456 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -171.69 1.89 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 109.485 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . 0.478 ' CG ' ' OXT' ' B' ' 91' ' ' GLU . 1.5 pt-20 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.468 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.521 ' HB3' ' CB ' ' B' ' 9' ' ' ALA . 1.9 mp0 -67.17 -73.01 0.15 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.216 -0.927 . . . . 0.0 109.455 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' B' ' 10' ' ' LEU . 0.9 OUTLIER -44.52 -29.73 0.77 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.48 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -52.84 48.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.217 -0.927 . . . . 0.0 109.654 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -62.21 -26.1 68.17 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.209 -0.932 . . . . 0.0 109.494 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -72.94 -24.41 60.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.515 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' B' ' 81' ' ' THR . 6.8 tpt -80.86 -55.84 4.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.482 HG11 ' N ' ' A' ' 9' ' ' ALA . 9.9 p -60.97 -24.39 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.195 -0.941 . . . . 0.0 109.614 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.506 ' CB ' ' HB3' ' B' ' 2' ' ' GLU . . . -77.43 -66.64 0.81 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.558 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.528 ' CD1' ' HE2' ' A' ' 74' ' ' MET . 4.1 mm? -43.82 -50.37 7.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.687 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.522 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 17.9 tt -57.61 -45.61 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 109.604 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.522 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.07 -25.72 59.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.27 -0.894 . . . . 0.0 109.865 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.585 ' CG1' ' CD1' ' A' ' 35' ' ' LEU . 2.7 t -87.08 -28.15 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.1 -1.0 . . . . 0.0 109.725 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 7.1 t80 -66.3 -50.18 64.52 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.919 -1.113 . . . . 0.0 109.389 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -79.33 -31.99 43.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.25 -0.906 . . . . 0.0 109.684 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.4 tt0 -66.22 -65.59 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 109.544 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.581 ' CG ' HD13 ' A' ' 35' ' ' LEU . 19.7 m-85 -56.9 -45.0 82.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.31 -0.869 . . . . 0.0 109.604 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.463 ' O ' ' O ' ' A' ' 23' ' ' ASP . 18.1 m -67.8 -20.55 65.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.179 -0.951 . . . . 0.0 109.56 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.85 -7.79 76.19 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 23.8 mtp180 -70.68 -64.47 0.89 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -1.146 . . . . 0.0 109.482 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.37 170.05 11.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.278 -0.889 . . . . 0.0 109.438 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . -62.03 88.05 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER 162.07 89.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.379 -1.071 . . . . 0.0 109.307 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.42 35.14 0.76 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.259 -0.901 . . . . 0.0 109.672 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -151.13 16.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.191 -0.943 . . . . 0.0 109.682 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -170.31 168.25 8.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.124 -0.985 . . . . 0.0 109.579 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 89.2 mt -120.0 149.99 41.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.437 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.1 OUTLIER -105.33 94.27 5.13 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 -179.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.463 ' O ' HD11 ' A' ' 32' ' ' LEU . 2.0 ttmt 37.01 -84.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.703 -0.623 . . . . 0.0 111.276 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.613 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.8 m -45.18 -46.96 12.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.916 -1.115 . . . . 0.0 109.919 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.527 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -45.38 -46.9 13.45 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.036 -1.04 . . . . 0.0 109.32 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 2.5 mp -60.81 -60.95 2.98 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.592 -0.692 . . . . 0.0 109.247 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.502 ' HD3' ' CG1' ' A' ' 53' ' ' VAL . 1.2 mmmm -38.93 -36.43 0.28 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.508 -0.745 . . . . 0.0 109.748 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -68.44 -61.49 1.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.111 -0.993 . . . . 0.0 109.255 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.595 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 0.1 OUTLIER -41.41 -51.52 3.73 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.697 . . . . 0.0 109.882 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.53 ' HA ' ' CD2' ' A' ' 40' ' ' LEU . 53.9 mt -60.61 -50.94 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 110.435 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.558 ' ND2' ' N ' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -81.75 12.04 4.3 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.972 -1.08 . . . . 0.0 109.955 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.46 ' O ' ' OE1' ' A' ' 39' ' ' GLU . 1.4 t-20 -140.83 12.17 2.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.521 ' HB3' ' CD1' ' B' ' 3' ' ' LEU . 6.8 mm-40 -151.55 -35.7 0.13 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.007 -1.058 . . . . 0.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.576 ' O ' ' CB ' ' A' ' 41' ' ' SER . 2.1 mm? -44.22 -74.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.018 -1.051 . . . . 0.0 109.432 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.576 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 2.1 p 156.02 -86.35 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.419 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -153.12 -39.15 0.1 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.484 -0.76 . . . . 0.0 109.081 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.419 ' C ' ' O ' ' A' ' 42' ' ' HIS . 85.8 m-85 -43.68 -34.47 1.49 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.344 -0.847 . . . . 0.0 109.358 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.532 ' CD1' ' CG1' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -147.21 83.01 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.684 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.516 ' O ' ' CB ' ' A' ' 46' ' ' GLU . 3.1 pp20? -117.83 136.6 53.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.352 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' CB ' ' O ' ' A' ' 45' ' ' GLU . 15.0 tt0 77.99 -3.98 2.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.344 -0.848 . . . . 0.0 109.691 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.525 ' CD1' HG22 ' A' ' 53' ' ' VAL . 3.3 mm 51.61 101.36 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.272 -0.892 . . . . 0.0 109.683 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -44.12 -33.27 1.44 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.501 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 15.7 tt0 -179.85 68.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.513 ' N ' HG23 ' A' ' 47' ' ' ILE . 2.9 mt-30 43.85 56.51 4.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.506 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.14 -69.98 0.69 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.244 -0.91 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.528 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.9 t -89.24 -12.35 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.188 -0.945 . . . . 0.0 109.534 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.525 HG22 ' CD1' ' A' ' 47' ' ' ILE . 95.0 t -82.52 -26.26 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.123 -0.985 . . . . 0.0 109.17 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -87.49 -36.55 17.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.136 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.88 -47.29 15.33 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.378 -0.826 . . . . 0.0 109.209 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.545 HG12 ' CD1' ' A' ' 60' ' ' LEU . 1.5 p -62.96 -43.41 99.0 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 O-C-N 121.194 -0.941 . . . . 0.0 109.253 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.515 ' CE ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -46.09 -42.36 13.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.45 179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -57.62 12.15 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.476 HG21 ' O ' ' A' ' 56' ' ' VAL . 6.0 t -63.6 -12.91 37.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.231 -0.918 . . . . 0.0 109.616 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -79.77 -30.04 40.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -0.858 . . . . 0.0 109.452 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 0.5 OUTLIER -89.92 104.73 17.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -99.94 1.14 42.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.286 -0.884 . . . . 0.0 109.585 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.91 -22.49 6.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.933 . . . . 0.0 109.527 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 85.78 99.21 0.74 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER 167.34 -27.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.272 -1.134 . . . . 0.0 108.622 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.42 -14.59 30.28 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.402 ' OE2' ' N ' ' A' ' 67' ' ' GLU . 2.7 mm-40 -79.61 111.42 15.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -1.097 . . . . 0.0 109.31 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.4 t -69.68 156.55 38.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.88 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.489 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -118.57 171.83 7.91 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.418 -0.801 . . . . 0.0 108.843 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -62.63 -51.54 66.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.17 -0.956 . . . . 0.0 110.194 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.469 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 5.7 mt-30 -56.03 -33.1 64.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 0.0 109.062 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.489 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 1.1 mm-40 -81.79 -22.12 37.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.388 -0.82 . . . . 0.0 109.02 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 37.9 t80 -66.78 -58.03 5.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.393 -0.817 . . . . 0.0 109.1 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.541 ' HB3' ' CB ' ' B' ' 78' ' ' ALA . 4.1 tpt -64.35 -47.96 77.35 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 109.153 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.556 ' CB ' ' CB ' ' B' ' 75' ' ' ALA . . . -57.05 -29.48 63.46 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.157 -0.964 . . . . 0.0 108.686 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.599 ' CE2' ' CG2' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -62.0 -66.19 0.58 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.488 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.599 ' CG2' ' CE2' ' A' ' 76' ' ' PHE . 55.1 t -55.52 -22.2 11.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.532 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -59.79 -49.16 78.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.513 -0.742 . . . . 0.0 109.154 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 20.3 mtp -76.64 -65.67 0.91 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.84 0.829 . . . . 0.0 109.664 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.575 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -47.64 -21.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 120.449 -1.407 . . . . 0.0 110.108 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 21.9 m -83.49 -63.56 1.33 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 0.0 108.612 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.586 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.3 m -79.62 -53.13 7.14 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.562 ' CB ' ' O ' ' A' ' 79' ' ' MET . . . -35.26 -33.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.2 0.524 . . . . 0.0 109.946 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.6 t -89.54 -41.96 11.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.476 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.429 ' N ' ' O ' ' A' ' 82' ' ' THR . 13.8 m170 -50.88 -56.44 12.27 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 109.47 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 1.4 tt0 -67.36 -19.47 65.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.435 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 36.7 t80 -46.09 -48.69 17.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.267 -0.895 . . . . 0.0 109.476 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.446 ' O ' ' O ' ' A' ' 89' ' ' GLU . 1.2 m-85 -48.94 -48.23 42.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.923 . . . . 0.0 109.468 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' A' ' 88' ' ' PHE . 1.3 mm-40 60.55 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 109.437 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.5 ' N ' ' ND1' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -51.74 93.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.239 -0.913 . . . . 0.0 109.433 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 89' ' ' GLU . 2.9 tt0 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.985 -1.007 . . . . 0.0 109.5 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.463 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 20.4 m . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.506 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 3.8 mm-40 -73.08 -55.12 6.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 109.257 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.595 ' CD1' ' CD2' ' A' ' 35' ' ' LEU . 2.8 mt -76.51 -11.52 59.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.847 . . . . 0.0 109.418 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' B' ' 7' ' ' MET . 0.1 OUTLIER -74.61 -54.57 7.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.192 -0.942 . . . . 0.0 108.815 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -20.01 58.79 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.303 -0.873 . . . . 0.0 109.068 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -81.96 -30.47 31.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.388 -0.82 . . . . 0.0 109.568 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.486 ' O ' ' CG1' ' B' ' 11' ' ' ILE . 1.3 ppp? -80.32 -32.01 38.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.133 -0.979 . . . . 0.0 109.392 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.445 ' N ' ' HG3' ' B' ' 7' ' ' MET . 55.4 t -73.09 -49.13 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.127 -0.983 . . . . 0.0 109.17 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.521 ' CB ' ' HB3' ' A' ' 2' ' ' GLU . . . -69.11 -43.91 73.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.346 -0.846 . . . . 0.0 109.613 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.584 ' CD2' ' CD2' ' A' ' 3' ' ' LEU . 50.0 mt -61.96 -28.3 69.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.209 -0.932 . . . . 0.0 109.802 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.578 HD12 ' CZ ' ' B' ' 70' ' ' PHE . 5.2 mm -72.16 -43.45 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.374 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.468 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 1.3 t70 -67.8 -36.9 81.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.293 -0.88 . . . . 0.0 110.161 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.602 ' O ' ' CD1' ' B' ' 17' ' ' TYR . 1.3 m -75.03 -34.48 32.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.046 -1.034 . . . . 0.0 110.083 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 69.5 t80 -61.76 -52.23 65.07 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.685 -1.26 . . . . 0.0 109.234 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.429 ' O ' ' C ' ' B' ' 16' ' ' GLN . 29.1 m80 -74.71 -60.46 2.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.25 -0.906 . . . . 0.0 109.755 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.468 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 2.3 tt0 -42.73 -47.21 5.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.287 -0.883 . . . . 0.0 109.684 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.644 ' CD2' ' CD1' ' B' ' 35' ' ' LEU . 3.0 m-85 -58.29 -52.16 66.74 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.207 -0.933 . . . . 0.0 109.056 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.462 ' OG ' HD22 ' B' ' 27' ' ' LEU . 12.2 m -51.86 -27.06 11.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.439 -0.788 . . . . 0.0 109.551 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . -66.95 -41.51 93.26 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 1.3 mmt180 -43.66 -48.51 7.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -1.128 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' B' ' 20' ' ' ARG . 22.0 mt-10 -162.78 148.3 12.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.278 -0.889 . . . . 0.0 109.439 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 87.87 75.98 1.28 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' B' ' 22' ' ' GLY . 2.2 m-20 43.74 -148.8 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.177 -1.19 . . . . 0.0 109.523 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -144.5 68.8 1.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.432 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.3 -38.56 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.918 . . . . 0.0 109.471 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -113.15 169.88 8.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.917 . . . . 0.0 109.401 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.481 ' HB3' ' HB3' ' B' ' 31' ' ' GLU . 12.8 mt -93.97 138.73 31.76 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -0.96 . . . . 0.0 109.612 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.554 ' O ' ' CG ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER -94.46 82.65 4.05 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.382 -0.824 . . . . 0.0 109.504 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 6.8 ttmt 44.43 -91.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.113 -0.992 . . . . 0.0 110.196 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 28' ' ' LYS . 45.0 m -43.22 -36.88 1.92 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.872 -1.143 . . . . 0.0 110.071 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.481 ' HB3' ' HB3' ' B' ' 27' ' ' LEU . 1.4 mp0 -43.04 -51.43 5.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.084 -1.01 . . . . 0.0 110.352 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' B' ' 29' ' ' LYS . 0.3 OUTLIER -74.63 -35.67 62.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.19 -0.944 . . . . 0.0 109.068 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -52.15 -27.67 15.17 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.054 -1.029 . . . . 0.0 108.741 178.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.512 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -83.32 -52.34 6.64 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.297 -0.877 . . . . 0.0 108.828 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.644 ' CD1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -43.12 -38.96 2.6 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.438 -0.789 . . . . 0.0 108.98 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.539 ' CG2' ' HB2' ' B' ' 40' ' ' LEU . 3.8 mt -78.8 -39.1 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 O-C-N 121.561 -0.712 . . . . 0.0 109.318 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.405 ' O ' ' OG ' ' B' ' 41' ' ' SER . 1.9 m-80 -75.94 -0.25 20.81 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.505 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.26 -53.08 3.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.161 -0.962 . . . . 0.0 109.069 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 3' ' ' LEU . 1.0 OUTLIER -105.31 -28.48 10.88 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.001 179.609 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.539 ' HB2' ' CG2' ' B' ' 36' ' ' ILE . 74.3 mt -98.02 56.32 1.22 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.406 -0.809 . . . . 0.0 109.37 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' B' ' 37' ' ' ASN . 11.5 m -113.16 -4.39 13.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -81.64 -90.77 0.07 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.146 -0.971 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -72.6 -3.82 27.09 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.528 HD21 ' CG2' ' B' ' 36' ' ' ILE . 0.1 OUTLIER -98.81 64.05 1.44 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.261 -0.9 . . . . 0.0 109.586 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -101.01 174.52 5.97 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.199 -0.938 . . . . 0.0 109.431 179.938 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' B' ' 45' ' ' GLU . 1.1 tt0 77.76 -3.45 2.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.345 -0.847 . . . . 0.0 109.755 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.537 ' CD1' HG23 ' B' ' 36' ' ' ILE . 4.8 mt -71.36 -6.56 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.104 -0.997 . . . . 0.0 109.444 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -76.77 3.28 12.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.132 -0.98 . . . . 0.0 109.52 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.49 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 1.2 mm-40 -123.54 14.66 9.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.209 -0.932 . . . . 0.0 108.98 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.524 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 75.04 54.21 0.07 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.397 -0.814 . . . . 0.0 109.546 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.08 -70.8 0.65 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.192 -0.943 . . . . 0.0 109.502 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.54 ' CG1' ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -93.87 -24.31 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.108 -0.995 . . . . 0.0 108.753 179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.527 ' HA ' ' CG2' ' B' ' 56' ' ' VAL . 45.8 t -77.22 -17.23 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.356 -0.84 . . . . 0.0 108.869 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.524 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 41.0 t0 -84.18 -46.71 11.6 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.365 -0.835 . . . . 0.0 109.113 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -71.45 -49.8 38.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.236 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.535 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 21.4 m -54.21 -46.74 68.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.134 -0.978 . . . . 0.0 109.352 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.521 ' HG2' ' CE ' ' B' ' 29' ' ' LYS . 7.4 tpt -43.54 -44.55 6.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 109.719 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -54.43 45.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.209 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.474 HG23 ' O ' ' B' ' 56' ' ' VAL . 4.9 t -71.55 -9.09 57.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 109.542 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.633 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -90.88 -10.83 41.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.37 -0.831 . . . . 0.0 109.459 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.417 ' OD1' ' HE1' ' B' ' 57' ' ' MET . 11.6 m-20 -90.14 82.43 6.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 109.294 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -85.01 13.17 6.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -160.76 27.29 0.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.518 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' OD1' ' B' ' 65' ' ' ASP . . . 49.94 68.5 1.37 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' B' ' 64' ' ' GLY . 0.4 OUTLIER -177.06 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.275 -1.133 . . . . 0.0 108.603 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.12 8.25 25.8 Favored Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 1.4 mt-10 -69.91 85.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -1.136 . . . . 0.0 109.455 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 4.1 m -69.95 140.79 53.07 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.446 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -100.67 172.71 6.92 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.7 OUTLIER -64.97 -58.83 5.1 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.101 -0.999 . . . . 0.0 110.463 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.525 ' CG ' ' HA ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -50.92 -49.67 59.14 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.166 -0.959 . . . . 0.0 109.272 -179.511 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.642 ' CB ' ' CZ ' ' B' ' 76' ' ' PHE . 1.3 mm-40 -68.06 -24.56 65.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.382 -0.824 . . . . 0.0 109.021 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.585 ' CZ ' HD23 ' B' ' 35' ' ' LEU . 1.7 t80 -66.05 -60.75 2.53 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.479 -0.763 . . . . 0.0 109.606 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.532 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 2.6 mtm -53.55 -34.86 59.77 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.0 109.159 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.556 ' CB ' ' CB ' ' A' ' 75' ' ' ALA . . . -68.86 -34.25 75.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.12 -0.987 . . . . 0.0 108.723 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CZ ' ' CB ' ' B' ' 72' ' ' GLU . 20.4 m-30 -65.31 -66.17 0.58 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.527 ' CG1' HD13 ' B' ' 40' ' ' LEU . 57.4 t -47.2 -26.72 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.541 ' CB ' ' HB3' ' A' ' 74' ' ' MET . . . -56.95 -64.72 0.78 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 6.0 mtm -56.86 -61.91 2.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.197 -0.939 . . . . 0.0 109.408 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.54 ' HA ' ' CG1' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.35 -22.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 O-C-N 120.66 -1.275 . . . . 0.0 109.528 -179.183 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.533 ' CG2' ' CE ' ' A' ' 7' ' ' MET . 30.2 m -79.0 -69.46 0.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.929 -1.107 . . . . 0.0 109.055 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.3 t -76.41 -48.89 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.142 -0.974 . . . . 0.0 109.073 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.568 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.91 -35.16 0.09 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.749 -0.594 . . . . 0.0 110.022 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.526 ' CB ' ' HG ' ' B' ' 44' ' ' LEU . 2.7 t -89.64 -37.49 14.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -0.964 . . . . 0.0 109.712 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.448 ' O ' ' ND1' ' B' ' 85' ' ' HIS . 1.3 t60 -64.96 -12.12 46.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.205 -0.935 . . . . 0.0 109.551 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.5 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 5.6 pt-20 -90.15 -33.96 16.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 0.0 109.6 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.481 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.5 t80 -68.3 -19.22 64.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.507 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -10.03 59.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -106.33 169.6 8.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.934 . . . . 0.0 109.484 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.469 ' N ' ' CD2' ' B' ' 90' ' ' HIS . 0.1 OUTLIER -166.26 40.48 0.05 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 109.495 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 118.039 -0.981 . . . . 0.0 109.492 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.448 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 49.7 m . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.515 ' HG3' ' CG2' ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.26 -95.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.895 . . . . 0.0 109.66 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.535 ' HB2' ' CG ' ' B' ' 39' ' ' GLU . 7.3 mp -47.23 -29.31 2.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.1 -1.0 . . . . 0.0 109.739 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.564 ' OE2' ' CD2' ' B' ' 42' ' ' HIS . 0.5 OUTLIER -52.14 -60.4 3.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.148 -0.97 . . . . 0.0 109.172 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -35.01 79.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.329 -0.857 . . . . 0.0 109.018 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -69.87 -10.76 59.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.88 -47.61 7.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.303 -0.873 . . . . 0.0 109.196 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.464 ' O ' HG21 ' A' ' 11' ' ' ILE . 52.4 t -64.68 -27.16 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.304 -0.873 . . . . 0.0 109.233 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HB2' ' CA ' ' B' ' 2' ' ' GLU . . . -85.54 -58.29 2.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.341 -0.849 . . . . 0.0 109.366 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.59 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 3.8 mt -49.14 -34.28 13.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 0.0 109.337 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.529 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 3.3 tt -76.21 -46.06 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 109.53 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.529 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -55.12 -21.32 12.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.331 -0.855 . . . . 0.0 109.552 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.608 ' CG1' ' CZ ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -90.13 -39.63 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.141 -0.974 . . . . 0.0 109.674 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 25.3 t80 -53.73 -41.92 67.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.819 -1.175 . . . . 0.0 108.858 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -79.25 -44.43 21.78 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.341 -0.849 . . . . 0.0 109.205 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' A' ' 15' ' ' HIS . 1.7 tt0 -44.4 -38.93 4.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.268 -0.895 . . . . 0.0 108.82 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.615 ' CE2' ' CD2' ' A' ' 35' ' ' LEU . 80.8 m-85 -94.08 -78.04 0.44 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.525 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 24.4 p 39.05 28.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.594 -0.691 . . . . 0.0 110.006 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' TYR . . . 76.9 51.82 6.12 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 17' ' ' TYR . 32.7 mtp180 -40.65 -29.52 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.5 -1.0 . . . . 0.0 109.732 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -98.5 85.89 3.47 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.237 -0.915 . . . . 0.0 109.428 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 103.69 91.87 2.22 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 9.8 t70 70.94 154.97 0.14 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.199 -1.177 . . . . 0.0 109.402 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.525 ' CA ' ' OG ' ' A' ' 18' ' ' SER . 10.9 mttp -134.64 60.44 1.7 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.521 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t-80 -130.42 -35.18 1.54 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.21 -0.931 . . . . 0.0 109.558 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -140.83 167.43 22.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.4 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.534 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 9.0 mt -88.92 170.06 11.03 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.138 -0.976 . . . . 0.0 109.719 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 2.6 ptmm? -138.92 71.12 1.38 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.375 -0.828 . . . . 0.0 109.238 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 64.9 -83.08 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.581 -0.699 . . . . 0.0 110.225 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 91.0 p -41.98 -55.57 3.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.559 ' OE1' ' CD1' ' A' ' 17' ' ' TYR . 2.8 mm-40 -45.92 -45.82 15.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.028 . . . . 0.0 108.717 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.521 ' CD1' ' SD ' ' A' ' 57' ' ' MET . 16.3 mt -52.14 -68.25 0.19 Allowed 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' CG1' ' A' ' 53' ' ' VAL . 19.3 mttt -38.27 -31.08 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.558 -0.714 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 31' ' ' GLU . 7.9 mm-40 -67.45 -67.61 0.44 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.085 -1.01 . . . . 0.0 109.169 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.615 ' CD2' ' CE2' ' A' ' 17' ' ' TYR . 18.6 mt -43.85 -45.69 7.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.337 -0.852 . . . . 0.0 109.461 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.626 ' CD1' ' CE1' ' A' ' 76' ' ' PHE . 44.7 mm -54.05 -62.0 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.384 -0.822 . . . . 0.0 109.672 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.577 ' HB3' ' CD2' ' A' ' 43' ' ' PHE . 10.8 m120 -83.08 16.7 2.25 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.34 -0.85 . . . . 0.0 110.162 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m120 -142.06 16.94 2.1 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.037 -1.04 . . . . 0.0 109.742 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.548 ' HG3' ' N ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -158.4 -33.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.955 -1.091 . . . . 0.0 110.563 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.548 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 2.0 mm? -53.49 -68.94 0.13 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.926 -1.109 . . . . 0.0 109.644 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.499 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER 161.31 -76.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.837 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.574 ' CE1' ' HA ' ' A' ' 44' ' ' LEU . 6.2 p80 -90.89 22.52 3.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.286 -0.884 . . . . 0.0 108.997 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 37' ' ' ASN . 3.6 m-85 62.57 27.21 16.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.473 -0.767 . . . . 0.0 109.811 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.578 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 1.7 mm? 45.41 25.89 0.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.071 -1.018 . . . . 0.0 109.211 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 2.2 mt-10 70.73 47.89 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.234 -0.916 . . . . 0.0 109.186 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.468 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER 42.74 32.81 0.41 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.359 -0.838 . . . . 0.0 109.427 -179.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.521 HD11 ' CG2' ' A' ' 53' ' ' VAL . 1.2 mt 50.12 98.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.276 -0.89 . . . . 0.0 109.119 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 17.1 ptpt -40.1 -35.44 0.39 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.463 -0.773 . . . . 0.0 109.873 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 11.8 pt-20 178.13 -31.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.855 . . . . 0.0 109.435 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.54 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mt-30 165.17 50.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.328 -0.857 . . . . 0.0 109.147 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -90.32 -70.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.895 . . . . 0.0 110.135 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.547 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 0.7 OUTLIER -86.2 -23.37 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.127 -0.983 . . . . 0.0 109.954 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.521 ' CG2' HD11 ' A' ' 47' ' ' ILE . 83.7 t -81.69 -32.16 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 120.793 -1.192 . . . . 0.0 109.405 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.54 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -90.58 -28.35 18.52 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.188 -0.945 . . . . 0.0 109.499 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 10.3 tptm -87.34 -42.48 12.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.713 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.569 HG12 ' CE1' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -73.93 -29.8 26.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.118 -0.989 . . . . 0.0 109.127 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.554 ' N ' HG11 ' A' ' 56' ' ' VAL . 6.9 tpt -49.42 -39.33 32.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.359 -0.838 . . . . 0.0 109.48 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.33 -48.2 20.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.859 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.479 HG22 ' CE ' ' A' ' 79' ' ' MET . 3.9 t -66.1 -9.53 31.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.583 HD12 ' CZ ' ' A' ' 76' ' ' PHE . 35.2 mt -82.68 -52.83 6.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 109.347 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.515 ' OD2' ' CE ' ' A' ' 57' ' ' MET . 1.0 OUTLIER -75.76 86.9 2.77 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.49 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.64 25.72 2.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 109.428 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -121.8 -27.76 4.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.46 94.67 1.02 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.7 -31.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.267 -1.137 . . . . 0.0 108.576 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.11 -23.91 19.92 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.524 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 4.8 mm-40 -83.94 136.7 33.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.22 -1.165 . . . . 0.0 109.409 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.479 ' HB3' ' OE1' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -71.84 170.47 13.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.223 -0.923 . . . . 0.0 109.927 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 69' ' ' ASP . 0.4 OUTLIER -136.78 171.4 14.56 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.5 OUTLIER -61.4 -62.2 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.799 -1.188 . . . . 0.0 110.354 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.532 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 0.9 OUTLIER -47.79 -28.67 2.66 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.034 -1.041 . . . . 0.0 108.918 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.534 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -73.22 -43.13 61.77 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.548 -0.72 . . . . 0.0 109.64 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.608 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 29.2 t80 -56.24 -54.36 46.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.875 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.538 ' CB ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -56.4 -58.19 9.08 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.047 -1.033 . . . . 0.0 109.344 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.496 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -57.75 -17.38 15.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.2 -0.938 . . . . 0.0 108.975 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.626 ' CE1' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.66 -70.43 0.32 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.457 -0.777 . . . . 0.0 109.138 179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.522 ' CG1' ' OE2' ' A' ' 39' ' ' GLU . 46.5 t -52.23 -29.52 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.427 -0.795 . . . . 0.0 109.188 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.525 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -64.22 -41.95 96.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.28 -0.888 . . . . 0.0 109.709 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.558 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 18.3 mtm -78.19 -70.42 0.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 109.73 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.526 HG11 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -43.82 -23.96 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.472 -1.393 . . . . 0.0 109.695 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.502 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.8 m -80.34 -68.13 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.0 108.871 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.2 t -77.51 -49.3 15.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.181 -0.949 . . . . 0.0 108.796 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.571 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.05 -43.34 0.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.05 -28.76 18.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.314 -0.866 . . . . 0.0 109.607 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -69.65 -9.69 55.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.907 . . . . 0.0 109.592 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.415 ' HA ' ' CE1' ' A' ' 88' ' ' PHE . 0.9 OUTLIER -88.44 -10.16 50.08 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.203 -0.936 . . . . 0.0 109.497 -179.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 88' ' ' PHE . 0.4 OUTLIER -62.82 -21.93 66.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 0.0 109.547 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.575 ' CG ' ' N ' ' A' ' 89' ' ' GLU . 19.0 p90 -43.61 -45.95 7.0 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' N ' ' CG ' ' A' ' 88' ' ' PHE . 2.3 tt0 43.63 93.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.266 -0.896 . . . . 0.0 109.628 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -144.41 81.39 1.66 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.44 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.532 179.988 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.424 ' HB3' ' HB2' ' B' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.471 ' CA ' ' HB2' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -59.68 -72.53 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.196 -0.94 . . . . 0.0 109.833 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.59 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 3.6 mm? -73.69 -31.64 63.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.0 109.89 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.424 ' HB2' ' HB3' ' B' ' 1' ' ' SER . 3.3 tt0 -56.97 -58.92 6.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.212 -0.93 . . . . 0.0 109.389 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -64.36 -31.09 72.16 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.86 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -75.97 -14.01 60.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.0 109.507 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.409 ' HE2' ' O ' ' A' ' 40' ' ' LEU . 2.4 mtp -86.87 -37.75 17.4 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 24.6 t -73.83 -34.64 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -0.907 . . . . 0.0 109.397 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.76 -43.27 37.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.663 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.575 HD11 ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -66.47 -55.46 15.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 45.0 mt -52.35 -47.8 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -0.858 . . . . 0.0 109.72 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -63.16 -33.74 76.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.607 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.595 ' CG1' ' CD1' ' B' ' 35' ' ' LEU . 0.9 OUTLIER -73.53 -15.69 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.224 -0.923 . . . . 0.0 109.339 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.555 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 13.4 t80 -82.89 -44.98 14.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.965 -1.084 . . . . 0.0 108.981 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.456 ' O ' ' OG ' ' B' ' 18' ' ' SER . 75.1 m-70 -66.24 -31.21 71.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.411 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 4.2 tt0 -81.04 -50.46 9.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.158 -0.964 . . . . 0.0 109.407 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.527 ' O ' ' CD2' ' B' ' 27' ' ' LEU . 10.0 m-85 -78.68 4.03 14.8 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.308 -0.87 . . . . 0.0 109.574 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.536 ' HA ' ' CD2' ' B' ' 27' ' ' LEU . 2.1 p -83.36 41.45 0.77 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.194 -0.941 . . . . 0.0 109.76 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . 103.99 55.67 0.77 Allowed Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' B' ' 16' ' ' GLN . 11.9 mtp85 -45.02 -26.39 0.43 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.31 -1.112 . . . . 0.0 109.132 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -132.06 117.22 18.08 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.327 -0.858 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.04 -109.62 3.76 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -63.62 178.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 109.421 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' B' ' 18' ' ' SER . 15.4 ttmm -161.51 56.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.512 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -161.64 -36.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.587 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' B' ' 68' ' ' CYS . 33.1 mtmt -131.67 170.16 15.16 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.144 -0.972 . . . . 0.0 109.481 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.536 ' CD2' ' HA ' ' B' ' 18' ' ' SER . 4.0 mt -95.29 142.9 27.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.172 -0.955 . . . . 0.0 109.918 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.523 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 9.4 pttp -124.32 74.29 1.3 Allowed 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.418 -0.801 . . . . 0.0 108.874 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 4.6 tppt? 68.3 -81.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.692 -0.63 . . . . 0.0 110.283 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -49.47 -46.02 47.52 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.083 -1.011 . . . . 0.0 110.406 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' CG ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -58.18 -34.64 70.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.0 -1.062 . . . . 0.0 109.618 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.528 ' CD2' HD21 ' B' ' 60' ' ' LEU . 12.1 mt -67.98 -69.57 0.31 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.478 -0.763 . . . . 0.0 109.51 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 8.8 mtpt -40.76 -27.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.396 -0.815 . . . . 0.0 110.171 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.498 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.5 OUTLIER -76.91 -58.75 3.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.034 -1.041 . . . . 0.0 109.424 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.595 ' CD1' ' CG1' ' B' ' 13' ' ' VAL . 23.4 tp -41.37 -47.16 3.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.641 ' CD1' ' CE2' ' B' ' 76' ' ' PHE . 1.3 mp -78.16 -38.95 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.0 110.082 -179.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' B' ' 33' ' ' LYS . 2.1 m-80 -80.29 4.53 17.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.927 -1.108 . . . . 0.0 110.044 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.464 ' OD1' ' OE1' ' B' ' 34' ' ' GLU . 1.0 OUTLIER -126.68 -16.08 5.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.09 -1.006 . . . . 0.0 109.937 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.535 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 64.9 mm-40 -123.86 -9.74 7.76 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.109 -0.995 . . . . 0.0 109.633 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.522 ' CD1' ' HB ' ' B' ' 80' ' ' VAL . 37.0 mt -117.29 67.17 0.74 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.199 -0.938 . . . . 0.0 109.685 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.58 ' O ' ' CG ' ' B' ' 42' ' ' HIS . 0.4 OUTLIER -112.56 46.88 1.14 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.336 -0.852 . . . . 0.0 109.087 179.681 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' B' ' 41' ' ' SER . 93.4 m-70 -160.9 99.71 1.24 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.378 -0.826 . . . . 0.0 108.91 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.531 ' CB ' ' O ' ' B' ' 42' ' ' HIS . 4.0 m-85 81.67 17.3 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.654 -0.654 . . . . 0.0 109.415 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.523 ' CD2' ' O ' ' B' ' 80' ' ' VAL . 0.1 OUTLIER -123.52 -9.5 7.96 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 44' ' ' LEU . 1.8 mm-40 45.89 -171.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.229 -0.919 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' B' ' 48' ' ' LYS . 4.4 mm-40 -83.01 158.76 22.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.222 -0.924 . . . . 0.0 109.419 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.564 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 24.6 mm -58.53 -24.05 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.172 -0.955 . . . . 0.0 109.431 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 5.8 mttt 83.09 -42.67 0.1 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.692 -0.63 . . . . 0.0 109.713 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.8 OUTLIER 164.52 -25.26 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.097 -1.002 . . . . 0.0 109.368 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 165.11 51.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.265 -0.897 . . . . 0.0 109.574 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.46 ' OE1' ' HE3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.14 -70.66 0.66 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.135 -0.978 . . . . 0.0 109.558 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.527 ' O ' ' CG1' ' B' ' 56' ' ' VAL . 1.4 t -90.85 -24.79 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.231 -0.918 . . . . 0.0 108.982 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.517 HG22 ' CD1' ' B' ' 47' ' ' ILE . 69.7 t -72.39 -22.22 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.283 -0.885 . . . . 0.0 108.928 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.475 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 7.6 t70 -86.91 -53.47 4.88 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.302 -0.874 . . . . 0.0 109.111 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.47 -42.52 78.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.287 -0.883 . . . . 0.0 109.122 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.527 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 35.2 m -61.85 -47.36 93.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 O-C-N 121.235 -0.915 . . . . 0.0 109.196 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.441 ' C ' ' O ' ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.08 -27.62 0.22 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.4 OUTLIER -77.58 -47.44 19.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.336 -0.853 . . . . 0.0 108.699 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.454 ' O ' ' C ' ' B' ' 60' ' ' LEU . 9.2 m -76.26 -66.44 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.378 -0.826 . . . . 0.0 109.095 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.649 ' CD2' ' CD2' ' B' ' 76' ' ' PHE . 1.5 mp -39.9 -30.16 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.51 -0.744 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' B' ' 59' ' ' THR . 48.9 t0 -90.21 110.68 21.71 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.232 -0.918 . . . . 0.0 109.425 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -141.98 25.5 1.93 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -0.955 . . . . 0.0 109.531 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.62 -15.54 8.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 90.33 55.31 1.97 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 8.0 t70 179.28 -33.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.228 -1.16 . . . . 0.0 108.634 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.426 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.1 34.34 2.37 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.451 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 7.2 mm-40 -104.87 114.44 28.64 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -1.147 . . . . 0.0 109.434 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.483 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 12.0 t -70.1 158.31 35.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.278 -0.889 . . . . 0.0 109.617 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.483 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.8 OUTLIER -132.05 171.18 13.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.405 -0.809 . . . . 0.0 108.924 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.426 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.1 OUTLIER -53.2 -48.36 68.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.321 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.4 ' O ' ' HB1' ' B' ' 75' ' ' ALA . 2.0 pt20 -59.27 -36.01 74.75 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.345 -0.847 . . . . 0.0 108.826 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.469 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 0.6 OUTLIER -82.23 -12.34 58.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.409 -0.807 . . . . 0.0 109.217 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.575 ' CE2' HD11 ' B' ' 10' ' ' LEU . 3.8 t80 -73.11 -57.92 3.68 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.525 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 46.4 mtt -68.31 -44.33 75.66 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.388 -0.82 . . . . 0.0 109.332 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.496 ' HB1' ' CB ' ' A' ' 75' ' ' ALA . . . -59.82 -40.6 89.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -0.876 . . . . 0.0 109.406 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.649 ' CD2' ' CD2' ' B' ' 60' ' ' LEU . 1.2 t80 -57.43 -68.73 0.21 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.271 -0.893 . . . . 0.0 109.131 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.494 ' O ' ' CB ' ' B' ' 81' ' ' THR . 71.2 t -52.45 -22.69 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.538 ' HB1' ' CB ' ' A' ' 74' ' ' MET . . . -62.07 -50.87 70.25 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.56 -0.713 . . . . 0.0 109.206 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.562 ' O ' ' N ' ' B' ' 83' ' ' ALA . 29.7 mtp -74.01 -66.92 0.66 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.43 -0.794 . . . . 0.0 109.366 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.64 ' CG2' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -42.59 -25.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.502 -1.374 . . . . 0.0 109.631 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.494 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 5.9 m -78.63 -70.01 0.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.982 -1.074 . . . . 0.0 108.722 178.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.562 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.1 t -77.82 -49.07 15.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.226 -0.921 . . . . 0.0 108.765 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' B' ' 79' ' ' MET . . . -39.39 -44.09 1.29 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.684 -0.635 . . . . 0.0 109.543 179.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.454 ' SG ' ' HA ' ' B' ' 44' ' ' LEU . 46.4 t -73.27 -40.37 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.861 . . . . 0.0 109.478 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.17 -13.49 48.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.22 -0.925 . . . . 0.0 109.398 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -77.23 -40.57 44.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.46 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -30.79 70.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -53.32 -36.0 60.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -105.76 98.95 8.57 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.205 -0.934 . . . . 0.0 109.492 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -166.8 158.3 12.72 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.251 -0.906 . . . . 0.0 109.451 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.475 -179.965 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.444 ' HG2' ' CB ' ' B' ' 9' ' ' ALA . 41.4 tt0 -80.29 -61.75 1.88 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.446 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.527 HD13 ' CD1' ' B' ' 10' ' ' LEU . 12.1 tp -64.43 -11.09 29.75 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.269 -0.895 . . . . 0.0 109.473 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -89.16 -53.32 4.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.243 -0.911 . . . . 0.0 109.411 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.86 -27.28 63.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.911 . . . . 0.0 109.373 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -70.2 -32.67 70.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.412 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.467 ' HE2' ' HG ' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -71.33 -43.33 67.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.46 ' O ' HG21 ' A' ' 11' ' ' ILE . 9.0 t -71.45 -28.4 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.0 109.656 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -78.39 -68.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.927 . . . . 0.0 109.581 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.579 ' CD2' ' CD1' ' B' ' 3' ' ' LEU . 81.4 mt -43.71 -48.51 7.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.591 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.522 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -58.97 -44.45 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.867 . . . . 0.0 109.633 -179.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.522 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 5.8 t70 -66.65 -19.2 65.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 110.063 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.579 HG11 ' CD1' ' A' ' 17' ' ' TYR . 2.7 t -88.58 -29.51 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.03 -1.044 . . . . 0.0 109.607 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -71.33 -46.06 61.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.824 -1.172 . . . . 0.0 109.12 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.403 ' CD2' ' HG2' ' A' ' 24' ' ' LYS . 16.4 t-80 -77.8 -34.71 51.99 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.538 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -68.94 -63.83 0.98 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.919 . . . . 0.0 109.418 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.628 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 36.7 m-85 -53.73 -38.52 64.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.251 -0.905 . . . . 0.0 109.435 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 18.7 m -68.39 -30.97 70.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.17 -0.956 . . . . 0.0 109.492 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' HA2' ' HG3' ' A' ' 24' ' ' LYS . . . -57.22 -19.06 30.6 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.6 mmt180 -72.3 -38.06 68.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.248 -1.148 . . . . 0.0 109.444 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -78.26 164.15 25.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.242 -0.912 . . . . 0.0 109.491 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -50.51 -51.91 30.65 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.458 ' HB2' ' OE2' ' A' ' 21' ' ' GLU . 42.5 m-20 -78.17 -173.35 3.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -1.169 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HG3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -142.08 56.06 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 109.449 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.506 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 76.0 t60 -169.99 32.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 109.483 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 9.2 ptpt -170.03 170.31 7.61 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.197 -0.94 . . . . 0.0 109.524 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 87.4 mt -134.64 129.96 35.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 109.78 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -78.75 166.51 22.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.181 -0.95 . . . . 0.0 108.763 179.266 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.478 ' CG ' ' SD ' ' A' ' 57' ' ' MET . 11.3 mttt -42.65 -27.22 0.16 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 0.0 109.672 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -77.59 -58.38 3.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.968 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.53 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 16.6 mm-40 -46.76 -42.83 17.5 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.087 -1.008 . . . . 0.0 109.296 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.522 ' CD2' HD11 ' A' ' 60' ' ' LEU . 1.7 mp -59.03 -65.87 0.6 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.558 -0.714 . . . . 0.0 109.204 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.581 ' CG ' ' CG1' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -41.58 -32.09 0.33 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.311 -0.868 . . . . 0.0 109.685 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -67.48 -61.73 1.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.212 -0.93 . . . . 0.0 109.468 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.628 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 2.0 mm? -40.92 -51.35 3.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.912 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.563 HG13 ' CZ ' ' A' ' 76' ' ' PHE . 46.6 mt -62.07 -44.17 98.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 110.025 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.462 ' OD1' HG12 ' A' ' 47' ' ' ILE . 72.7 m-20 -88.13 9.93 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.0 109.954 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 1.7 t-20 -105.62 -26.39 11.87 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.118 -0.989 . . . . 0.0 109.085 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.53 ' HG3' ' CB ' ' B' ' 3' ' ' LEU . 0.0 OUTLIER -134.88 -35.3 0.87 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.405 -0.809 . . . . 0.0 109.547 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.563 ' CD1' ' N ' ' A' ' 40' ' ' LEU . 7.8 mp -86.32 15.1 5.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.569 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.36 -9.04 29.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -122.65 -10.34 8.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -91.21 -39.51 12.06 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.263 -0.898 . . . . 0.0 109.489 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.525 ' CD1' ' O ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -123.97 32.89 5.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.31 -0.869 . . . . 0.0 109.448 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.427 ' O ' ' C ' ' A' ' 46' ' ' GLU . 1.5 mt-10 43.8 71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.251 -0.906 . . . . 0.0 109.543 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.451 ' O ' HD12 ' A' ' 44' ' ' LEU . 14.3 mm-40 43.74 -151.65 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.295 -0.878 . . . . 0.0 109.571 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.599 ' O ' ' N ' ' A' ' 49' ' ' GLU . 34.8 mm -121.96 -58.45 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.311 -0.868 . . . . 0.0 109.606 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.505 ' CG ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 43.81 -81.99 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.933 0.873 . . . . 0.0 110.478 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 47' ' ' ILE . 13.4 mm-40 -46.02 -33.55 3.47 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.522 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.3 tt0 76.4 32.88 0.56 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 109.351 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 3.3 mm-40 -72.69 -49.49 31.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.529 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 0.3 OUTLIER -91.52 -18.16 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.197 -0.939 . . . . 0.0 109.37 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.581 ' CG1' ' CG ' ' A' ' 33' ' ' LYS . 25.1 t -82.0 -37.84 15.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 120.793 -1.192 . . . . 0.0 109.022 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.09 -29.66 17.18 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.983 -1.073 . . . . 0.0 109.3 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 25.1 tttm -90.91 -35.51 14.69 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.321 -0.862 . . . . 0.0 110.559 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.541 ' CG1' HD13 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -90.52 -25.64 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 120.846 -1.159 . . . . 0.0 110.361 -178.924 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.532 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -71.96 -49.62 35.78 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.848 -1.157 . . . . 0.0 109.22 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -35.84 74.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.12 -0.988 . . . . 0.0 108.82 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.457 ' CG2' ' HA ' ' A' ' 56' ' ' VAL . 5.6 t -90.31 -9.83 46.35 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.443 -0.785 . . . . 0.0 109.422 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.576 HD12 ' CD1' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -65.89 -45.96 80.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.368 -0.833 . . . . 0.0 109.448 -179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.452 ' OD2' ' HE3' ' A' ' 57' ' ' MET . 9.0 m-20 -61.34 88.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.42 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -71.63 -10.27 59.52 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 0.0 109.504 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.78 -37.29 10.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.516 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 97.78 93.37 1.93 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 39.1 t0 178.61 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.269 -1.136 . . . . 0.0 108.658 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.444 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 110.18 19.08 8.24 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 26' ' ' LYS . 53.5 mt-10 -127.15 129.25 47.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -1.137 . . . . 0.0 109.47 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.46 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 8.6 t -69.74 155.54 40.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.639 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.503 ' N ' ' OD1' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -126.17 171.44 10.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.453 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -61.47 -50.46 72.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.124 -0.985 . . . . 0.0 110.501 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 2.8 pt20 -58.4 -40.09 81.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.947 . . . . 0.0 108.836 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 1.1 tt0 -80.6 -12.24 59.54 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.571 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 19.3 t80 -69.94 -51.99 28.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.197 -0.94 . . . . 0.0 108.503 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.533 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 26.9 mtt -68.98 -43.47 74.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.522 ' CB ' ' HB1' ' B' ' 75' ' ' ALA . . . -67.33 -20.32 65.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 108.652 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' A' ' 60' ' ' LEU . 1.1 t80 -68.13 -57.95 5.24 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.522 ' CG2' HD13 ' B' ' 3' ' ' LEU . 55.0 t -66.86 -25.87 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 121.334 -0.854 . . . . 0.0 108.758 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.52 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -68.51 -27.27 65.97 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.429 -0.795 . . . . 0.0 109.065 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.561 ' O ' ' N ' ' A' ' 83' ' ' ALA . 11.6 mtm -84.2 -70.09 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 108.971 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.534 HG11 ' CB ' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -45.65 -23.02 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 O-C-N 120.302 -1.498 . . . . 0.0 109.892 -179.658 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.551 ' CG2' ' N ' ' A' ' 82' ' ' THR . 4.0 t -85.25 -52.26 6.03 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.747 -1.221 . . . . 0.0 109.327 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.589 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.1 t -90.82 -51.31 5.43 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.705 -1.221 . . . . 0.0 107.705 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.589 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -37.02 -42.06 0.39 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.369 0.604 . . . . 0.0 109.628 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.42 -37.02 23.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.289 -0.882 . . . . 0.0 109.428 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.422 ' N ' ' O ' ' A' ' 82' ' ' THR . 2.8 t-160 -60.19 -16.15 30.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 89' ' ' GLU . 79.8 mm-40 -85.89 -38.36 18.14 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.219 -0.926 . . . . 0.0 109.43 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.11 -52.02 67.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 0.0 109.451 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -69.06 -68.85 0.37 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.318 -0.864 . . . . 0.0 109.459 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -73.45 136.64 44.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.458 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -132.01 142.92 49.74 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.211 -0.931 . . . . 0.0 109.483 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.429 -179.979 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.51 ' HG3' ' CG2' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -45.52 -71.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.255 -0.903 . . . . 0.0 109.622 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.579 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 4.0 mm? -57.6 -20.22 31.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.278 -0.889 . . . . 0.0 109.816 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.462 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -62.58 -62.38 1.78 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.196 -0.94 . . . . 0.0 109.521 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.526 ' O ' ' CB ' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -59.39 -40.38 86.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.272 -0.892 . . . . 0.0 109.661 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.519 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -68.45 -20.23 64.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.196 -0.94 . . . . 0.0 109.566 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.519 ' O ' ' CG1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -74.98 -59.37 2.77 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.548 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.465 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 3.4 t -76.52 -11.39 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 109.473 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' B' ' 5' ' ' LYS . . . -81.85 -68.41 0.7 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.265 -0.897 . . . . 0.0 109.533 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.58 ' O ' ' CE2' ' B' ' 73' ' ' PHE . 3.5 mm? -62.23 -30.09 70.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.431 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.519 ' CG1' ' O ' ' B' ' 7' ' ' MET . 74.2 mt -69.85 -47.55 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.903 -1.123 . . . . 0.0 108.785 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' B' ' 8' ' ' VAL . 0.5 OUTLIER -53.62 -37.86 63.47 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.622 ' HB ' ' CE2' ' B' ' 17' ' ' TYR . 0.8 OUTLIER -72.99 -40.41 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 O-C-N 121.136 -0.978 . . . . 0.0 109.495 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 5.9 t80 -45.61 -47.21 14.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.836 -1.165 . . . . 0.0 108.224 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -80.3 -26.93 38.62 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.436 -0.79 . . . . 0.0 109.551 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -68.06 -70.15 0.28 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.995 . . . . 0.0 108.915 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.627 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 40.3 m-85 -49.71 -48.79 49.66 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.333 -0.854 . . . . 0.0 109.319 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 81.2 p -56.33 -35.35 67.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 109.716 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.465 ' HA2' ' HG2' ' B' ' 24' ' ' LYS . . . -66.58 -36.25 91.12 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 2.5 mmt180 -44.01 -28.29 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.276 -1.131 . . . . 0.0 109.513 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.456 ' HB3' ' HE3' ' B' ' 28' ' ' LYS . 5.9 mm-40 -126.64 156.11 41.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.452 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.43 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . -44.03 161.49 0.07 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.418 ' HB2' ' NZ ' ' B' ' 26' ' ' LYS . 25.6 m-20 55.18 100.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.266 -1.138 . . . . 0.0 109.447 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.465 ' HG2' ' HA2' ' B' ' 19' ' ' GLY . 15.0 mtmt -99.34 64.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.472 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.563 ' CD2' ' O ' ' B' ' 25' ' ' HIS . 16.1 t60 -139.86 8.32 2.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.221 -0.925 . . . . 0.0 109.647 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.11 170.19 7.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.173 -0.955 . . . . 0.0 109.591 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.532 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 15.5 mt -107.63 148.84 28.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 1.9 ptpt -124.74 85.47 2.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.692 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' B' ' 30' ' ' SER . 24.5 ttmt 59.66 -86.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.371 -0.831 . . . . 0.0 110.231 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.502 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 10.1 m -42.97 -56.37 3.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 0.0 110.184 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.532 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 1.3 mp0 -47.49 -42.15 22.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.057 -1.027 . . . . 0.0 109.538 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.53 ' CD2' ' HB2' ' B' ' 27' ' ' LEU . 26.6 mt -55.39 -61.79 2.11 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.598 -0.689 . . . . 0.0 109.476 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.438 ' HE2' HG12 ' B' ' 53' ' ' VAL . 6.0 ttmt -47.89 -70.19 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.272 -0.893 . . . . 0.0 109.705 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.459 ' OE2' ' HA ' ' B' ' 31' ' ' GLU . 18.8 pt-20 -44.07 -28.76 0.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.16 -0.962 . . . . 0.0 109.463 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.627 ' CD2' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -58.75 -57.74 11.66 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.848 . . . . 0.0 109.479 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.643 ' CD1' ' CZ ' ' B' ' 76' ' ' PHE . 2.6 mp -74.07 -55.11 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.687 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.422 ' C ' ' O ' ' B' ' 36' ' ' ILE . 4.9 m120 -41.75 -27.6 0.12 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.308 -0.87 . . . . 0.0 109.771 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.524 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 3.1 m-20 -90.79 -45.65 8.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.189 -0.944 . . . . 0.0 109.549 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CG1' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -73.25 -65.65 0.78 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.165 -0.959 . . . . 0.0 109.511 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' B' ' 40' ' ' LEU . 8.5 mp -62.88 -49.71 73.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.257 -0.902 . . . . 0.0 109.48 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.515 ' O ' ' CB ' ' B' ' 42' ' ' HIS . 0.1 OUTLIER 57.2 70.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.203 -0.936 . . . . 0.0 109.376 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.515 ' CB ' ' O ' ' B' ' 41' ' ' SER . 0.7 OUTLIER 76.47 -0.97 2.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.322 -0.861 . . . . 0.0 109.593 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.467 ' HB2' ' CA ' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -65.77 -12.45 54.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 109.427 179.928 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.527 HD23 ' CG2' ' B' ' 36' ' ' ILE . 2.6 pt? -134.88 28.75 3.51 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.265 -0.897 . . . . 0.0 109.401 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' B' ' 46' ' ' GLU . 6.6 tt0 58.38 40.42 24.31 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.334 -0.854 . . . . 0.0 109.511 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.428 ' OE2' ' CE1' ' B' ' 42' ' ' HIS . 0.5 OUTLIER 44.07 -153.02 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.235 -0.916 . . . . 0.0 109.373 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.528 ' CD1' HG22 ' B' ' 53' ' ' VAL . 0.6 OUTLIER -117.84 99.25 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.26 -0.9 . . . . 0.0 109.181 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' B' ' 49' ' ' GLU . 2.8 ptpt -43.41 -26.89 0.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.853 . . . . 0.0 109.528 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.514 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.1 tt0 178.36 -32.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.449 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.526 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 1.2 mt-30 165.09 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.287 -0.883 . . . . 0.0 109.451 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -70.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.18 -0.95 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.537 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 2.4 t -90.18 -24.37 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.206 -0.934 . . . . 0.0 109.238 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.528 HG22 ' CD1' ' B' ' 47' ' ' ILE . 40.0 t -75.97 -29.86 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.219 -0.926 . . . . 0.0 108.885 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.526 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 6.8 t0 -79.82 -39.67 30.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.326 -0.859 . . . . 0.0 108.895 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.476 ' O ' HG22 ' B' ' 59' ' ' THR . 44.3 mmtt -65.54 -51.93 56.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 109.029 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.573 ' HA ' HG22 ' B' ' 59' ' ' THR . 16.5 m -55.8 -45.93 79.73 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 O-C-N 121.287 -0.883 . . . . 0.0 109.641 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.494 ' HE1' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.01 -31.66 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.809 -1.182 . . . . 0.0 110.224 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.465 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.1 OUTLIER -90.63 -35.98 14.66 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.142 -0.974 . . . . 0.0 109.361 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.573 HG22 ' HA ' ' B' ' 56' ' ' VAL . 0.8 OUTLIER -73.15 -60.33 2.29 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.387 -0.82 . . . . 0.0 110.031 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.627 ' CD1' ' CG ' ' B' ' 76' ' ' PHE . 2.9 mt -45.33 -44.21 11.45 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.923 . . . . 0.0 109.61 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 57' ' ' MET . 19.9 p-10 -89.95 111.53 22.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 109.494 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -98.34 -23.13 15.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.569 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -82.26 -20.01 38.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.552 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.26 94.21 0.61 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 173.11 -30.62 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.259 -1.142 . . . . 0.0 108.599 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.29 21.14 7.08 Favored Glycine 0 N--CA 1.485 1.926 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -107.74 99.72 9.17 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.246 -1.149 . . . . 0.0 109.409 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 17.2 t -72.43 157.4 37.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.191 -0.943 . . . . 0.0 109.698 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.475 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 1.1 m-20 -117.17 171.58 7.85 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.498 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.1 OUTLIER -59.05 -50.2 74.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.305 -179.715 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.463 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 18.4 mt-30 -55.81 -45.53 78.28 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.27 -0.894 . . . . 0.0 108.944 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.455 ' OE1' ' O ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -76.82 -13.29 60.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.408 -0.807 . . . . 0.0 109.395 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.58 ' CE2' ' O ' ' B' ' 10' ' ' LEU . 6.5 t80 -70.72 -66.88 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.191 -0.943 . . . . 0.0 108.607 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.52 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 4.1 mtt -58.59 -39.03 79.24 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.341 -0.849 . . . . 0.0 108.884 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.522 ' HB1' ' CB ' ' A' ' 75' ' ' ALA . . . -64.64 -29.8 70.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.294 -0.879 . . . . 0.0 109.059 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.643 ' CZ ' ' CD1' ' B' ' 36' ' ' ILE . 2.0 t80 -64.45 -63.7 1.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.422 -0.798 . . . . 0.0 109.287 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.525 ' CG1' ' OE2' ' B' ' 39' ' ' GLU . 49.5 t -56.9 -25.71 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.334 -0.854 . . . . 0.0 109.111 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.533 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -66.11 -41.81 90.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.325 -0.859 . . . . 0.0 109.415 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.543 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 3.0 mtm -73.79 -67.1 0.63 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.261 -0.899 . . . . 0.0 109.41 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.563 HG23 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -44.46 -25.04 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 120.637 -1.289 . . . . 0.0 109.247 -179.576 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.465 ' OG1' HD12 ' B' ' 40' ' ' LEU . 13.0 m -76.3 -70.05 0.47 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.154 -0.966 . . . . 0.0 108.963 178.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.6 t -77.13 -49.53 15.03 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.171 -0.956 . . . . 0.0 108.922 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.571 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.71 -31.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.757 -0.589 . . . . 0.0 109.774 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.477 ' N ' ' O ' ' B' ' 82' ' ' THR . 47.6 t -87.47 -42.25 12.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.317 -0.864 . . . . 0.0 109.535 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.2 OUTLIER -65.69 -9.96 32.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 109.536 -179.941 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.423 ' OE1' ' O ' ' B' ' 91' ' ' GLU . 0.4 OUTLIER -66.18 -17.65 64.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.191 -0.943 . . . . 0.0 109.506 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -73.85 -37.09 64.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -57.59 -69.91 0.15 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.261 -0.9 . . . . 0.0 109.511 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -106.42 149.33 27.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.302 -0.874 . . . . 0.0 109.496 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 61.56 174.75 0.12 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.483 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . 0.423 ' O ' ' OE1' ' B' ' 86' ' ' GLU . 1.2 tp10 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.477 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.517 ' HB3' ' CB ' ' A' ' 4' ' ' GLU . 1.3 m . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.521 ' OE1' ' CB ' ' B' ' 12' ' ' ASP . 0.5 OUTLIER -73.9 -38.89 64.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.578 ' CD1' ' CD2' ' B' ' 10' ' ' LEU . 2.9 mm? -80.33 -34.39 36.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.26 -0.9 . . . . 0.0 109.43 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.517 ' CB ' ' HB3' ' A' ' 1' ' ' SER . 25.9 tt0 -60.13 -58.34 8.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -63.11 -38.78 92.53 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.22 -0.925 . . . . 0.0 109.254 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.527 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -73.22 -11.87 60.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.254 -0.904 . . . . 0.0 109.399 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -42.84 16.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.437 ' O ' HG21 ' A' ' 11' ' ' ILE . 22.0 t -75.53 -25.87 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.405 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.98 -50.01 9.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.224 -0.923 . . . . 0.0 109.514 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.57 HD11 ' CZ ' ' A' ' 73' ' ' PHE . 3.9 mm? -62.52 -33.23 74.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.535 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -73.25 -46.33 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.926 . . . . 0.0 109.468 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.535 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 9.5 t70 -65.83 -16.94 64.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.292 -0.88 . . . . 0.0 109.414 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.576 HG13 ' CZ ' ' A' ' 73' ' ' PHE . 2.8 t -89.99 -37.3 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 0.0 109.359 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 68.7 t80 -62.83 -43.73 98.02 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.02 -1.05 . . . . 0.0 109.456 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 47.8 m170 -82.19 -49.93 9.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.303 -0.873 . . . . 0.0 109.795 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.2 tt0 -52.1 -59.75 4.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 109.612 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.625 ' CD2' ' CD2' ' A' ' 35' ' ' LEU . 44.7 m-85 -60.57 -48.71 80.59 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.897 . . . . 0.0 109.675 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.455 ' HB3' HD22 ' A' ' 27' ' ' LEU . 60.1 p -63.04 -11.61 20.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.208 -0.932 . . . . 0.0 109.689 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.515 ' HA2' ' CA ' ' A' ' 24' ' ' LYS . . . -70.69 -37.57 67.23 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 9.9 mmt180 -44.13 -41.63 5.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 8.5 tt0 -76.46 82.91 3.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 0.0 109.447 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.13 -91.15 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 21' ' ' GLU . 12.6 p30 -96.59 158.14 15.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' CA ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -89.63 119.91 30.46 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.31 -0.869 . . . . 0.0 109.449 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -169.58 -49.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -0.947 . . . . 0.0 109.693 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.503 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 3.6 mtmt -136.48 170.12 16.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 109.71 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.533 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 24.2 mt -102.43 150.36 23.44 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.292 -0.88 . . . . 0.0 109.463 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.523 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -115.56 70.05 0.74 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.171 -0.956 . . . . 0.0 109.854 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 63.34 -82.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.552 -0.717 . . . . 0.0 110.792 179.215 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.46 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 t -48.99 -29.09 4.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.034 -1.041 . . . . 0.0 110.32 -179.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.533 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 2.8 mp0 -66.84 -41.89 86.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.95 -1.094 . . . . 0.0 108.794 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.526 ' CD1' ' HE3' ' A' ' 57' ' ' MET . 14.8 mt -59.71 -61.22 2.78 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.526 ' CD ' HG13 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.49 -45.06 2.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.645 -0.66 . . . . 0.0 109.437 179.627 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.414 ' OE1' ' CA ' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -53.09 -61.32 2.38 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 109.319 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.625 ' CD2' ' CD2' ' A' ' 17' ' ' TYR . 3.2 mm? -54.81 -25.6 29.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.266 -0.896 . . . . 0.0 109.929 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.585 HD13 ' CE2' ' A' ' 76' ' ' PHE . 26.6 mm -64.09 -44.79 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.049 -1.032 . . . . 0.0 109.906 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.505 ' ND2' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -82.42 -52.73 6.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.114 -0.991 . . . . 0.0 109.931 -179.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.425 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.8 OUTLIER -40.52 -52.27 2.83 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.39 -0.818 . . . . 0.0 110.248 -179.584 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.535 ' HB3' ' CB ' ' B' ' 3' ' ' LEU . 0.1 OUTLIER -96.28 -26.12 15.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.058 -1.026 . . . . 0.0 109.949 -179.506 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.512 ' CD2' ' SD ' ' B' ' 7' ' ' MET . 5.7 mt -135.51 67.46 1.48 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.462 ' HB2' ' CA ' ' A' ' 37' ' ' ASN . 11.4 t -100.93 -18.63 16.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.863 . . . . 0.0 109.455 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -112.56 -41.42 3.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.251 -0.906 . . . . 0.0 109.45 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -58.69 -27.26 64.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 0.0 109.428 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 40' ' ' LEU . 1.9 mt -94.16 -16.03 24.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 67.69 65.32 0.39 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.511 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 2.2 tp10 64.9 23.42 12.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.285 -0.884 . . . . 0.0 109.405 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.535 ' CG2' HG22 ' A' ' 53' ' ' VAL . 6.7 mt 79.81 -9.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.559 -0.713 . . . . 0.0 110.072 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 0.6 OUTLIER 83.49 -43.5 0.1 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.509 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.5 mt-10 168.95 36.61 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.135 -0.978 . . . . 0.0 109.311 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 57.85 36.15 26.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 109.34 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -90.15 -37.38 14.23 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.262 -0.899 . . . . 0.0 109.756 -179.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.535 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 2.9 t -98.06 -28.42 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.108 -0.995 . . . . 0.0 109.83 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.574 ' CG2' ' CG2' ' A' ' 36' ' ' ILE . 25.3 t -73.15 -37.35 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.03 -1.044 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -22.32 21.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.143 -0.973 . . . . 0.0 109.281 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 23.8 tttt -84.1 -25.02 30.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.251 -0.906 . . . . 0.0 109.369 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.535 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 2.2 m -59.54 -48.26 87.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 O-C-N 121.235 -0.916 . . . . 0.0 109.852 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.526 ' HE3' ' CD1' ' A' ' 32' ' ' LEU . 15.0 tpp -45.34 -24.62 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.738 -1.226 . . . . 0.0 109.596 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 56' ' ' VAL . 5.7 mm-40 -88.81 -42.14 12.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 109.304 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.1 m -72.44 -62.39 1.46 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.926 . . . . 0.0 109.307 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.523 ' CD1' ' HB2' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -85.23 44.04 1.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 109.493 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 57' ' ' MET . 15.8 p-10 -77.9 109.98 12.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 109.337 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.523 ' CB ' ' O ' ' A' ' 67' ' ' GLU . 36.8 t30 -49.46 -52.38 29.48 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.163 -0.961 . . . . 0.0 109.44 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -165.49 22.97 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.0 109.997 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.44 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 69.78 94.61 0.06 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.44 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.2 OUTLIER 170.13 -29.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.327 -1.102 . . . . 0.0 108.366 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.46 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 110.21 17.11 9.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 62' ' ' ASN . 2.7 pt-20 -113.09 91.2 3.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.27 -1.135 . . . . 0.0 109.109 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.527 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.44 130.89 43.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.681 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' OD1' ' ND2' ' A' ' 62' ' ' ASN . 2.5 m-20 -101.56 170.55 8.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.409 -0.807 . . . . 0.0 108.876 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.411 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.95 -48.69 64.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.033 -1.042 . . . . 0.0 110.457 -179.702 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.51 ' O ' ' CE ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.28 -41.09 65.21 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 109.416 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.527 ' HG2' ' CA ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -74.53 -23.1 58.76 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 120.929 -1.107 . . . . 0.0 109.062 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.576 ' CZ ' HG13 ' A' ' 13' ' ' VAL . 18.3 t80 -64.07 -52.73 57.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.197 -0.939 . . . . 0.0 108.534 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.547 ' HB3' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.37 -37.85 82.03 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.19 -0.944 . . . . 0.0 108.995 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.529 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -72.73 -19.19 61.43 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.98 . . . . 0.0 108.939 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.585 ' CE2' HD13 ' A' ' 36' ' ' ILE . 9.8 t80 -71.84 -68.31 0.47 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.493 -0.754 . . . . 0.0 109.27 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.584 ' N ' ' CD1' ' A' ' 76' ' ' PHE . 39.3 t -66.42 -31.15 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.295 -0.878 . . . . 0.0 109.452 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -59.63 -40.66 88.36 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.282 -0.886 . . . . 0.0 109.384 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.569 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 2.1 mmt -77.76 -71.18 0.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.187 -0.945 . . . . 0.0 109.693 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.544 ' CG2' ' O ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -44.04 -24.39 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.296 -1.502 . . . . 0.0 109.736 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.509 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 13.1 m -77.09 -68.81 0.57 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 108.665 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.34 -49.74 11.11 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.577 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.19 -40.03 0.47 Allowed 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.334 0.588 . . . . 0.0 109.589 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.04 -32.88 16.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.263 -0.898 . . . . 0.0 109.477 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -66.34 -9.95 38.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.889 . . . . 0.0 109.534 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.38 -43.43 40.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.483 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.51 -31.25 1.05 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.8 -43.84 21.71 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.902 . . . . 0.0 109.522 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 65.94 23.47 11.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.444 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.43 89.62 2.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.903 . . . . 0.0 109.465 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.454 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.515 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.289 0.566 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -58.03 -75.74 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 109.66 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.535 ' CB ' ' HB3' ' A' ' 39' ' ' GLU . 5.9 mp -76.82 -29.68 56.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.606 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.515 ' HB3' ' CB ' ' B' ' 1' ' ' SER . 41.8 tt0 -58.03 -57.69 11.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.139 -0.976 . . . . 0.0 109.146 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.1 OUTLIER -61.27 -47.04 87.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.323 -0.861 . . . . 0.0 109.166 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -65.36 -12.68 54.42 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.288 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.512 ' SD ' ' CD2' ' A' ' 40' ' ' LEU . 8.6 ttt -80.81 -44.45 18.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.362 -0.836 . . . . 0.0 109.296 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.38 -44.81 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.898 . . . . 0.0 109.315 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.428 ' C ' ' HB3' ' A' ' 2' ' ' GLU . . . -67.84 -55.85 11.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.291 -0.88 . . . . 0.0 109.306 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.578 ' CD2' ' CD1' ' A' ' 3' ' ' LEU . 20.9 mt -45.37 -49.8 12.75 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.249 -0.907 . . . . 0.0 109.237 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.463 ' CD1' ' O ' ' B' ' 7' ' ' MET . 9.3 mt -60.17 -38.64 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.302 -0.874 . . . . 0.0 109.365 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -57.58 -28.64 63.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.608 ' CG1' ' CE1' ' B' ' 73' ' ' PHE . 2.1 t -82.92 -30.82 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.208 -0.933 . . . . 0.0 109.268 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.486 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 22.1 t80 -60.79 -51.1 70.75 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.84 -1.162 . . . . 0.0 109.211 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.447 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -80.16 -37.64 33.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.892 . . . . 0.0 109.615 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.2 tt0 -55.67 -65.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.211 -0.931 . . . . 0.0 109.487 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.572 ' CD2' ' HG ' ' B' ' 35' ' ' LEU . 28.8 m-85 -59.48 -49.73 76.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.552 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.509 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 53.2 p -57.95 -17.27 15.98 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.583 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.94 -37.22 16.53 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CZ ' ' OE1' ' B' ' 34' ' ' GLU . 56.4 mtp85 -46.22 -44.16 15.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -1.137 . . . . 0.0 109.465 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.58 169.97 17.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.432 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -48.37 -54.37 13.16 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' O ' ' O ' ' B' ' 18' ' ' SER . 73.2 m-20 -70.15 170.96 10.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -1.118 . . . . 0.0 109.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' B' ' 18' ' ' SER . 1.0 OUTLIER -141.22 70.52 1.35 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.863 . . . . 0.0 109.466 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.486 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -170.01 -36.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.362 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.515 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -121.89 170.19 10.04 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.919 . . . . 0.0 109.382 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.533 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 3.6 mp -102.21 144.92 30.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.952 . . . . 0.0 109.705 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -97.73 82.11 3.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.52 ' HG2' ' CG ' ' B' ' 57' ' ' MET . 0.0 OUTLIER 41.42 -83.87 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.591 -0.693 . . . . 0.0 110.955 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.604 ' N ' ' O ' ' B' ' 28' ' ' LYS . 4.7 t -48.5 -27.38 2.67 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.788 -1.195 . . . . 0.0 109.959 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.54 ' O ' ' CG ' ' B' ' 34' ' ' GLU . 2.8 mp0 -59.48 -47.01 87.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.894 -1.129 . . . . 0.0 108.38 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.522 ' N ' HD21 ' B' ' 27' ' ' LEU . 4.1 mt -59.11 -42.99 91.85 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.526 ' CG ' HG12 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -45.64 -67.73 0.26 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.517 -0.739 . . . . 0.0 109.722 179.715 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.54 ' CG ' ' O ' ' B' ' 31' ' ' GLU . 12.7 pt-20 -45.49 -44.28 12.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.151 -0.968 . . . . 0.0 109.786 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.572 ' HG ' ' CD2' ' B' ' 17' ' ' TYR . 3.2 mt -52.28 -45.73 65.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.1 -1.0 . . . . 0.0 109.617 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.579 HG13 ' CE1' ' B' ' 76' ' ' PHE . 11.9 mt -73.14 -23.84 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.258 -0.901 . . . . 0.0 109.853 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.541 ' ND2' ' N ' ' B' ' 37' ' ' ASN . 0.4 OUTLIER -95.18 -1.06 52.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.165 -0.959 . . . . 0.0 109.679 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -109.89 -20.06 12.89 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.159 -0.963 . . . . 0.0 109.285 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.535 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 10.9 mm-40 -121.44 -22.14 6.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.316 -0.865 . . . . 0.0 109.612 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.532 ' CD1' ' HB ' ' B' ' 80' ' ' VAL . 4.5 mt -110.5 59.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.219 -0.926 . . . . 0.0 109.535 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 88.4 p -123.88 1.23 8.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.29 -0.881 . . . . 0.0 109.555 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -111.22 -66.66 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.194 -0.941 . . . . 0.0 109.391 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -78.53 -36.6 44.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 109.394 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.434 HD11 ' HB3' ' B' ' 40' ' ' LEU . 3.2 mp -80.3 -173.36 3.99 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.242 -0.911 . . . . 0.0 109.46 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' B' ' 46' ' ' GLU . 6.0 mt-10 -120.85 44.62 2.45 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.236 -0.915 . . . . 0.0 109.393 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' B' ' 45' ' ' GLU . 4.2 mt-10 44.41 -167.89 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.366 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.524 ' CD1' HG22 ' B' ' 53' ' ' VAL . 2.3 mm -100.55 81.01 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.42 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER -43.34 -38.92 2.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.5 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -163.92 70.15 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.267 -0.896 . . . . 0.0 109.211 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.535 ' CG ' ' O ' ' B' ' 49' ' ' GLU . 16.5 pt20 41.91 37.48 0.81 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.435 -0.791 . . . . 0.0 109.546 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -65.23 -70.3 0.24 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 109.584 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 2.1 t -86.04 -13.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.125 -0.985 . . . . 0.0 109.439 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.526 HG12 ' CG ' ' B' ' 33' ' ' LYS . 69.0 t -81.03 -29.36 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.0 109.014 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.461 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 33.6 t70 -87.5 -26.1 23.36 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.203 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.2 -40.43 18.13 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 0.0 109.454 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.538 ' CG2' ' O ' ' B' ' 52' ' ' VAL . 21.0 m -59.83 -45.69 94.56 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 O-C-N 121.205 -0.934 . . . . 0.0 109.606 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.52 ' CG ' ' HG2' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -43.06 -27.36 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.969 -1.082 . . . . 0.0 109.258 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' B' ' 56' ' ' VAL . 4.1 mt-10 -83.25 -43.33 16.18 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.302 -0.874 . . . . 0.0 108.793 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.514 ' CG2' ' SD ' ' B' ' 79' ' ' MET . 38.1 m -75.46 -65.82 0.85 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.524 ' CD1' ' HB ' ' B' ' 56' ' ' VAL . 5.9 mt -41.03 -55.61 2.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.467 -0.771 . . . . 0.0 109.221 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.05 109.56 20.6 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.263 -0.898 . . . . 0.0 109.521 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.74 3.33 17.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' B' ' 64' ' ' GLY . 3.8 p30 -98.28 -45.83 6.03 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.516 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 102.06 95.13 2.26 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 57.5 t0 177.5 -32.86 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -1.134 . . . . 0.0 108.583 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.25 -21.62 24.1 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.448 ' HB3' ' HE3' ' B' ' 26' ' ' LYS . 26.0 mt-10 -75.82 106.71 7.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -1.134 . . . . 0.0 109.406 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.526 ' CB ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -69.68 124.03 22.9 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.237 -0.914 . . . . 0.0 109.437 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -92.14 171.0 9.38 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.389 -0.82 . . . . 0.0 109.112 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.411 ' CE2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.43 -50.62 67.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.929 -1.107 . . . . 0.0 109.871 -179.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.461 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -49.21 -29.96 6.36 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.328 -0.857 . . . . 0.0 109.635 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.539 ' HG3' ' N ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -79.13 -34.05 43.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.124 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.608 ' CE1' ' CG1' ' B' ' 13' ' ' VAL . 26.8 t80 -61.2 -55.88 27.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.059 -1.026 . . . . 0.0 108.993 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.522 ' CB ' ' HB3' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -62.39 -39.06 92.01 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.385 -0.822 . . . . 0.0 108.818 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.518 ' CB ' ' SD ' ' A' ' 74' ' ' MET . . . -67.75 -18.9 65.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.333 -0.854 . . . . 0.0 108.819 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.606 ' CG ' ' N ' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -71.72 -67.46 0.53 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.415 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.606 ' N ' ' CG ' ' B' ' 76' ' ' PHE . 41.4 t -56.94 -31.77 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.493 -0.754 . . . . 0.0 109.608 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.547 ' CB ' ' HB3' ' A' ' 74' ' ' MET . . . -66.55 -38.86 88.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.894 . . . . 0.0 110.147 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.566 ' O ' ' N ' ' B' ' 83' ' ' ALA . 9.4 mtp -78.35 -71.52 0.42 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.007 -1.058 . . . . 0.0 109.527 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.532 ' HB ' ' CD1' ' B' ' 40' ' ' LEU . 0.0 OUTLIER -43.36 -25.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.848 0 O-C-N 120.445 -1.409 . . . . 0.0 109.654 -179.562 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.481 ' N ' ' O ' ' B' ' 79' ' ' MET . 8.8 m -78.1 -68.79 0.6 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.963 -1.086 . . . . 0.0 108.612 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.6 t -79.32 -49.96 11.62 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.0 108.628 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.574 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -38.62 -41.2 0.67 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.334 0.588 . . . . 0.0 109.602 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 1.7 t -89.3 -33.48 16.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 0.0 109.551 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.459 ' HB2' ' O ' ' B' ' 81' ' ' THR . 3.2 t-160 -61.28 -15.41 34.92 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.431 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.3 -40.84 64.2 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.242 -0.911 . . . . 0.0 109.469 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -55.22 -39.63 69.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.488 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -50.76 -49.41 58.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.246 -0.909 . . . . 0.0 109.434 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -63.97 151.49 42.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.445 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -110.01 109.18 19.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.237 -0.914 . . . . 0.0 109.496 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.473 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.456 ' HB2' ' HB3' ' A' ' 4' ' ' GLU . 57.6 m . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.92 -71.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 109.824 -179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.524 ' CD1' ' HG ' ' B' ' 10' ' ' LEU . 3.2 mm? -73.23 -35.29 66.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.112 -0.992 . . . . 0.0 109.836 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.456 ' HB3' ' HB2' ' A' ' 1' ' ' SER . 19.6 tp10 -55.71 -63.16 1.26 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 109.505 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.51 -47.24 86.49 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 10' ' ' LEU . . . -64.49 -11.15 30.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.277 -0.889 . . . . 0.0 109.452 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.408 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 60.5 ttp -85.4 -41.24 15.61 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.465 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.457 ' O ' HG21 ' A' ' 11' ' ' ILE . 85.5 t -70.79 -29.79 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.521 ' CB ' ' HG3' ' B' ' 2' ' ' GLU . . . -78.93 -54.72 5.76 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.576 ' HG ' ' CZ ' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -55.92 -46.16 78.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.532 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.532 ' CG2' ' N ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -59.2 -46.17 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.183 -0.948 . . . . 0.0 109.308 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.532 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 2.7 t0 -59.01 -22.94 61.47 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.174 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.573 HG12 ' CD1' ' A' ' 17' ' ' TYR . 2.3 t -82.79 -27.4 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.189 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.485 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 22.4 t80 -69.9 -46.64 64.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.973 -1.079 . . . . 0.0 109.45 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -34.79 49.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.649 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.87 -63.32 1.08 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.248 -0.907 . . . . 0.0 109.597 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.577 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 37.5 m-85 -59.14 -51.92 67.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.305 -0.872 . . . . 0.0 109.623 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.48 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 13.9 m -62.41 -12.7 23.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.215 -0.928 . . . . 0.0 109.505 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -82.83 10.67 56.43 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 -39.4 17.37 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -1.17 . . . . 0.0 109.465 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.517 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 2.6 tt0 -84.15 82.1 8.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 109.467 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.49 -132.93 12.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 1.7 m-20 -64.03 -91.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -1.142 . . . . 0.0 109.484 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER 176.54 132.33 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.419 ' C ' ' HG3' ' A' ' 26' ' ' LYS . 15.3 p-80 -170.03 -53.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.149 -0.969 . . . . 0.0 109.835 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CE ' ' HB3' ' A' ' 67' ' ' GLU . 50.4 mtmt -148.74 170.19 18.76 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.128 -0.982 . . . . 0.0 109.843 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.502 HD21 ' N ' ' A' ' 32' ' ' LEU . 5.2 mp -94.35 152.16 18.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.282 -0.887 . . . . 0.0 109.806 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -116.65 69.25 0.75 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.111 -0.993 . . . . 0.0 109.324 179.585 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.44 ' HG2' ' HG3' ' A' ' 57' ' ' MET . 0.0 OUTLIER 62.71 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.625 -0.672 . . . . 0.0 110.639 179.352 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.5 p -50.64 -29.94 12.28 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.7 -1.25 . . . . 0.0 109.799 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 9.6 mt-10 -66.2 -42.54 88.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.04 -1.038 . . . . 0.0 108.274 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.6 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -54.12 -60.74 2.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.083 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.528 ' CD ' HG23 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.71 -53.07 4.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.798 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.36 -51.2 11.51 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.238 -0.913 . . . . 0.0 109.705 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.577 ' HG ' ' CE2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -57.35 -55.61 32.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.329 -0.857 . . . . 0.0 109.925 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.636 ' CD1' ' CE1' ' A' ' 76' ' ' PHE . 68.0 mt -64.61 -9.36 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.188 -0.945 . . . . 0.0 109.966 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 9.2 m120 -91.31 -74.43 0.5 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.076 -1.015 . . . . 0.0 109.563 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -62.02 -12.44 18.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.689 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.495 ' CG ' ' O ' ' A' ' 35' ' ' LEU . 6.1 mm-40 -110.83 -44.47 3.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.162 -0.961 . . . . 0.0 109.698 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.521 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . 1.9 mt -108.4 64.94 0.62 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.128 -0.983 . . . . 0.0 109.472 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -110.76 -5.5 14.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.328 -0.857 . . . . 0.0 109.558 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -88.69 -77.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.217 -0.927 . . . . 0.0 109.445 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.17 -26.83 30.11 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.241 -0.912 . . . . 0.0 109.453 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.521 ' CD1' ' HB3' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -142.88 78.66 1.62 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.5 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.466 ' HA ' ' O ' ' A' ' 41' ' ' SER . 35.5 tt0 -43.82 102.95 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.435 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 45' ' ' GLU . 3.1 mt-10 47.91 -174.87 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 109.37 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.511 HG23 ' CA ' ' A' ' 50' ' ' GLN . 2.5 mm -93.03 124.78 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.514 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -67.65 0.23 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.285 -0.885 . . . . 0.0 109.253 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 1.9 tt0 -139.45 42.2 2.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 109.238 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.518 ' HA ' ' CG1' ' A' ' 53' ' ' VAL . 0.2 OUTLIER 68.62 56.5 0.45 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.311 -0.868 . . . . 0.0 109.34 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -88.64 -70.35 0.65 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -0.933 . . . . 0.0 109.543 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.545 ' CG1' ' CG1' ' A' ' 80' ' ' VAL . 5.4 t -88.0 -23.36 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.13 -0.981 . . . . 0.0 109.289 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.528 HG23 ' CD ' ' A' ' 33' ' ' LYS . 2.8 p -72.5 -32.05 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.012 -1.055 . . . . 0.0 108.731 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.479 ' N ' HG11 ' A' ' 53' ' ' VAL . 23.0 t0 -90.37 -37.21 14.15 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.465 -0.772 . . . . 0.0 109.139 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 1.1 ttmt -68.43 -31.82 71.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.335 -0.853 . . . . 0.0 109.427 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 3.7 m -57.99 -49.69 80.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 O-C-N 121.224 -0.923 . . . . 0.0 109.703 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.469 ' O ' ' HB3' ' A' ' 61' ' ' ASP . 3.0 mmt -43.45 -26.88 0.23 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.807 -1.183 . . . . 0.0 109.496 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -78.37 -45.83 21.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.293 -0.879 . . . . 0.0 108.967 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 15.5 m -86.63 -62.16 1.57 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 109.382 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.6 ' CD2' ' CD2' ' A' ' 32' ' ' LEU . 4.7 mp -40.1 -28.25 0.05 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.412 -0.805 . . . . 0.0 109.981 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.469 ' HB3' ' O ' ' A' ' 57' ' ' MET . 8.9 p-10 -48.75 113.21 0.73 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.113 -0.992 . . . . 0.0 109.405 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -78.96 -49.97 11.9 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.209 -0.932 . . . . 0.0 109.503 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.11 -13.79 7.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.225 -0.922 . . . . 0.0 109.822 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 100.26 102.94 2.51 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' HB3' ' OE1' ' A' ' 67' ' ' GLU . 0.4 OUTLIER 167.31 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -1.111 . . . . 0.0 108.519 -179.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.56 -20.23 25.33 Favored Glycine 0 N--CA 1.485 1.911 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB3' ' CE ' ' A' ' 26' ' ' LYS . 6.8 mt-10 -69.9 103.28 2.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -1.146 . . . . 0.0 109.133 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.523 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.94 124.11 23.21 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.263 -0.898 . . . . 0.0 109.754 -179.36 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 29.9 t0 -94.21 170.46 9.5 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.457 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.3 OUTLIER -53.96 -51.62 63.29 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 110.214 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.486 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -51.48 -34.66 36.63 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.21 -0.931 . . . . 0.0 109.453 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.523 ' HG2' ' CA ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -79.13 -27.74 42.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.164 -0.96 . . . . 0.0 109.8 -179.73 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.576 ' CZ ' ' HG ' ' A' ' 10' ' ' LEU . 19.5 t80 -62.47 -49.74 74.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.001 -1.062 . . . . 0.0 108.571 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.544 ' O ' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -63.15 -41.67 99.31 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.037 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.494 ' HA ' ' SD ' ' B' ' 74' ' ' MET . . . -72.4 -12.07 60.96 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.636 ' CE1' ' CD1' ' A' ' 36' ' ' ILE . 6.7 t80 -71.58 -70.05 0.35 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.521 ' CG2' ' HG ' ' B' ' 3' ' ' LEU . 44.1 t -69.22 -25.46 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.143 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.56 ' CB ' ' CB ' ' B' ' 74' ' ' MET . . . -69.12 -34.49 75.13 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.472 -0.768 . . . . 0.0 109.527 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.568 ' O ' ' N ' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -79.12 -70.73 0.48 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.178 -0.951 . . . . 0.0 108.876 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.545 ' CG1' ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -44.46 -24.36 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 O-C-N 120.593 -1.317 . . . . 0.0 109.512 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.465 ' N ' ' O ' ' A' ' 79' ' ' MET . 8.2 m -78.56 -69.02 0.59 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 0.0 108.599 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.5 t -79.09 -50.1 11.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.944 . . . . 0.0 108.659 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.573 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.46 -40.41 0.56 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.329 0.585 . . . . 0.0 109.619 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.08 -31.97 16.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.516 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -64.64 -11.34 34.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 11.8 pt-20 -65.4 -13.71 59.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -82.36 -22.67 35.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.231 -0.918 . . . . 0.0 109.466 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -84.63 -18.28 35.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.897 . . . . 0.0 109.477 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 19.0 pt-20 -105.68 50.78 0.77 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.481 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -143.42 129.06 19.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 0.0 109.448 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.48 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.486 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 14.9 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.521 ' HG3' ' CB ' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -53.54 -60.44 3.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.254 -0.903 . . . . 0.0 109.588 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.562 ' CD1' ' CD1' ' A' ' 10' ' ' LEU . 3.6 mm? -69.51 -18.36 63.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.22 -0.925 . . . . 0.0 109.54 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' B' ' 1' ' ' SER . 0.6 OUTLIER -64.44 -63.4 1.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.383 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.91 -42.69 94.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.325 -0.859 . . . . 0.0 109.41 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.457 ' HA ' ' HB1' ' A' ' 6' ' ' ALA . . . -64.51 -23.13 67.17 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.237 -0.914 . . . . 0.0 109.509 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.461 ' O ' HG12 ' B' ' 11' ' ' ILE . 2.6 ttp -81.97 -29.75 32.01 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.57 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 47.1 t -72.52 -35.81 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.62 -52.23 12.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 109.499 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.581 ' CD2' ' CE2' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -57.33 -45.96 83.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.207 -0.933 . . . . 0.0 109.485 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.461 HG12 ' O ' ' B' ' 7' ' ' MET . 15.1 mm -55.07 -49.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.97 -20.54 66.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.579 ' CG1' ' CZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -76.33 -39.06 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 0.0 109.38 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 25.0 t80 -67.87 -46.4 71.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.956 -1.09 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.454 ' O ' ' HB2' ' B' ' 18' ' ' SER . 4.8 m80 -64.92 -54.59 28.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 0.0 109.66 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -56.14 -65.09 0.66 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.206 -0.934 . . . . 0.0 109.501 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.608 ' CZ ' ' CD1' ' B' ' 35' ' ' LEU . 39.1 m-85 -53.1 -20.39 3.68 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.282 -0.886 . . . . 0.0 109.474 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.458 ' O ' ' O ' ' B' ' 23' ' ' ASP . 0.5 OUTLIER -71.88 -50.63 27.66 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.722 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' B' ' 23' ' ' ASP . . . -90.5 53.78 3.45 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.512 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 15.0 mmm180 -90.2 -46.91 8.13 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -1.167 . . . . 0.0 109.603 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -139.1 81.47 1.84 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.177 -0.952 . . . . 0.0 109.85 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 85.5 -93.0 1.8 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' B' ' 18' ' ' SER . 16.2 m-20 -42.18 150.34 0.13 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.372 -1.075 . . . . 0.0 109.736 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.483 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 1.9 tmmt? -144.12 58.56 1.35 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 33.8 t60 -170.23 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 109.479 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -122.54 169.98 10.46 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 109.38 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.526 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 28.8 mt -119.34 127.81 53.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.947 . . . . 0.0 110.325 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.509 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -74.53 153.37 39.1 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.375 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.509 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 16.4 ttmt -36.86 -31.33 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.425 -0.797 . . . . 0.0 109.728 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 28' ' ' LYS . 2.8 t -72.35 -52.36 16.48 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.335 -0.853 . . . . 0.0 109.314 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.526 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -49.0 -44.95 41.71 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.115 -0.991 . . . . 0.0 108.553 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.523 HD23 ' CB ' ' B' ' 68' ' ' CYS . 28.7 mt -51.87 -67.13 0.28 Allowed 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.53 ' CG ' HG13 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.01 -28.92 0.09 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.416 -0.803 . . . . 0.0 109.789 179.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -70.06 -60.07 2.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.176 -0.952 . . . . 0.0 109.411 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.608 ' CD1' ' CZ ' ' B' ' 17' ' ' TYR . 11.9 tp -45.36 -48.44 13.33 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 0.0 109.654 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.647 ' CD1' ' CE1' ' B' ' 76' ' ' PHE . 31.1 mt -66.49 -34.64 71.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.213 -0.929 . . . . 0.0 109.562 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -86.14 7.15 26.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -0.903 . . . . 0.0 109.597 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.512 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 4.4 m-80 -105.21 -46.85 4.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.687 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.515 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 40.6 mp0 -124.9 -10.43 7.19 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.795 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.509 ' HB3' ' CD1' ' B' ' 44' ' ' LEU . 0.1 OUTLIER -102.47 -4.49 25.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 0.0 109.55 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -10.44 27.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.971 . . . . 0.0 109.483 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -77.01 -44.52 30.6 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -93.95 17.44 12.25 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.309 -0.869 . . . . 0.0 109.375 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.533 ' CD1' HG22 ' B' ' 36' ' ' ILE . 5.6 mt -141.41 101.33 3.98 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.281 -0.887 . . . . 0.0 109.358 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -65.59 87.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.238 -0.914 . . . . 0.0 109.528 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 2.3 tt0 66.38 30.25 8.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.934 . . . . 0.0 109.415 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.556 HG22 ' CG2' ' B' ' 53' ' ' VAL . 35.0 mm 65.22 9.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 36.19 44.68 0.29 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.671 -0.643 . . . . 0.0 109.846 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 1.6 pt-20 86.54 -172.47 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.528 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -85.07 63.92 8.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.012 -1.055 . . . . 0.0 109.539 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.64 -70.45 0.68 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.152 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.531 ' HB ' ' CG1' ' B' ' 80' ' ' VAL . 1.5 t -88.64 -25.0 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.102 -0.999 . . . . 0.0 109.623 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.556 ' CG2' HG22 ' B' ' 47' ' ' ILE . 2.5 t -72.46 -29.62 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 O-C-N 120.983 -1.073 . . . . 0.0 108.228 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.463 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.79 -42.13 10.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.0 109.123 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -33.56 76.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.349 -0.844 . . . . 0.0 109.589 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.53 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 2.9 m -52.55 -55.25 11.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.474 ' C ' ' O ' ' B' ' 56' ' ' VAL . 2.5 tpt -40.17 -34.28 0.3 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.072 -1.017 . . . . 0.0 109.692 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.23 -56.83 10.58 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.257 -0.902 . . . . 0.0 108.772 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.531 ' CG2' ' HE3' ' B' ' 79' ' ' MET . 4.9 m -76.53 -65.5 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.356 -0.84 . . . . 0.0 108.864 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.592 HD22 ' CG ' ' B' ' 76' ' ' PHE . 4.6 mp -32.44 -38.1 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.308 0.575 . . . . 0.0 110.258 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 59' ' ' THR . 37.9 t0 -84.92 71.43 10.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.907 . . . . 0.0 109.507 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -86.99 -10.42 53.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 109.429 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.51 -41.64 9.24 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.23 -0.919 . . . . 0.0 109.444 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.74 89.58 1.96 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 175.54 -31.97 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.313 -1.11 . . . . 0.0 108.662 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.09 -32.18 6.89 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.525 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 3.6 mm-40 -69.93 126.82 30.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.339 -1.094 . . . . 0.0 109.31 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.559 ' CA ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -78.47 130.57 36.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.087 -1.008 . . . . 0.0 109.561 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.499 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -105.26 170.39 7.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.269 -0.894 . . . . 0.0 109.286 179.708 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.419 ' HB3' HG22 ' A' ' 82' ' ' THR . 0.9 OUTLIER -49.4 -55.98 11.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.99 -1.069 . . . . 0.0 110.511 -179.742 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' B' ' 74' ' ' MET . 2.3 mt-30 -50.82 -32.63 20.71 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.177 -0.952 . . . . 0.0 109.73 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.559 ' HG2' ' CA ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -75.78 -32.71 60.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.948 -1.095 . . . . 0.0 109.543 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.607 ' CE1' ' CD2' ' B' ' 35' ' ' LEU . 3.0 t80 -62.66 -53.58 52.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.174 -0.954 . . . . 0.0 108.91 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.56 ' CB ' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -55.28 -46.96 76.15 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.541 -0.725 . . . . 0.0 109.795 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.571 ' CB ' ' CE ' ' B' ' 79' ' ' MET . . . -75.16 -14.28 60.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.075 -1.016 . . . . 0.0 109.195 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.647 ' CE1' ' CD1' ' B' ' 36' ' ' ILE . 1.9 t80 -71.83 -70.24 0.34 Allowed 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.396 -0.815 . . . . 0.0 109.317 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.515 ' O ' ' OG1' ' B' ' 81' ' ' THR . 39.4 t -59.47 -46.14 93.1 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.589 -0.694 . . . . 0.0 109.609 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.531 ' HB1' ' CG ' ' A' ' 74' ' ' MET . . . -51.99 -41.41 62.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.439 -0.788 . . . . 0.0 110.551 -179.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.571 ' CE ' ' CB ' ' B' ' 75' ' ' ALA . 12.6 mtm -69.83 -69.68 0.33 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.76 -1.213 . . . . 0.0 109.059 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.531 ' CG1' ' HB ' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -42.49 -23.96 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 120.867 -1.146 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.515 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 0.6 OUTLIER -77.54 -68.77 0.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.832 -1.168 . . . . 0.0 108.899 178.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -78.18 -49.95 12.86 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.138 -0.976 . . . . 0.0 108.367 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.581 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -36.77 -43.25 0.42 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.235 0.54 . . . . 0.0 109.846 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.45 ' SG ' ' HE3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -90.17 -31.94 16.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.532 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.46 ' HB2' ' HA ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -50.99 -34.59 29.68 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.285 -0.885 . . . . 0.0 109.584 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -46.67 -45.89 19.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.241 -0.912 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -46.38 -51.25 15.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.495 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' B' ' 87' ' ' PHE . 1.9 t80 -43.97 -69.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.477 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' B' ' 90' ' ' HIS . 0.0 OUTLIER -133.43 161.85 33.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 109.517 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER 71.17 56.66 0.21 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -0.894 . . . . 0.0 109.483 -179.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . 0.407 ' HG2' ' HA ' ' B' ' 87' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.437 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.415 ' HG3' ' C ' ' B' ' 9' ' ' ALA . 1.5 tp10 -64.58 -77.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.544 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD23 ' CD2' ' B' ' 35' ' ' LEU . 7.2 mp -71.5 -30.17 65.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -56.32 -57.64 11.41 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.0 109.459 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -62.03 -40.15 94.74 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.464 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.489 ' HA ' ' CB ' ' B' ' 6' ' ' ALA . . . -66.45 -17.06 64.58 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.464 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.524 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 36.3 ttp -84.46 -36.19 22.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.891 . . . . 0.0 109.514 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 t -68.03 -42.0 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.948 . . . . 0.0 109.522 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.444 ' CB ' ' HA ' ' B' ' 2' ' ' GLU . . . -77.32 -59.78 2.64 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.525 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 85.4 mt -47.77 -48.71 30.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.555 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.586 ' CD1' ' CZ ' ' A' ' 70' ' ' PHE . 23.6 mm -57.78 -48.14 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 3.1 t0 -62.98 -19.65 64.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.916 . . . . 0.0 109.554 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.624 ' CG1' ' CZ ' ' A' ' 73' ' ' PHE . 2.4 t -80.65 -29.72 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.301 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.464 ' O ' ' HB2' ' A' ' 18' ' ' SER . 15.1 t80 -73.73 -45.07 54.34 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.003 -1.061 . . . . 0.0 109.295 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.551 ' CE1' ' HD3' ' A' ' 24' ' ' LYS . 4.9 t60 -78.79 -29.36 44.93 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.301 -0.875 . . . . 0.0 109.617 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.6 tt0 -75.8 -62.25 1.65 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.494 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.49 ' CD1' HG11 ' A' ' 13' ' ' VAL . 27.9 m-85 -55.82 -48.09 76.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 14' ' ' PHE . 1.2 t -67.62 -20.04 65.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.923 . . . . 0.0 109.427 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.457 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -89.75 17.61 51.74 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -88.61 -57.53 2.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -1.166 . . . . 0.0 109.448 -179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -113.53 140.4 48.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.221 -0.924 . . . . 0.0 109.449 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.24 -119.11 4.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.491 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 4.2 m-20 -122.25 -80.67 0.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.224 -1.162 . . . . 0.0 109.463 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.565 ' O ' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER 165.51 99.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.499 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CD2' ' O ' ' A' ' 24' ' ' LYS . 55.1 m-70 -164.24 -41.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.519 ' CD ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -142.35 170.31 15.94 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.241 -0.912 . . . . 0.0 109.446 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB3' ' CB ' ' A' ' 31' ' ' GLU . 75.1 mt -112.01 134.26 53.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.92 . . . . 0.0 109.823 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 29' ' ' LYS . 3.6 mttt -81.79 165.16 21.14 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 28' ' ' LYS . 11.1 ptpt -45.0 -26.29 0.41 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.11 -0.994 . . . . 0.0 109.141 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 28' ' ' LYS . 4.9 p -82.43 -42.94 17.92 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.3 -0.875 . . . . 0.0 110.039 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.531 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 36.4 mm-40 -56.84 -42.91 80.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.972 -1.08 . . . . 0.0 108.666 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.561 ' CD1' ' CE ' ' A' ' 57' ' ' MET . 29.8 mt -62.66 -62.74 1.53 Allowed 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.526 ' HG3' ' CG1' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.62 -28.44 0.07 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.415 -0.803 . . . . 0.0 109.677 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -70.97 -58.36 3.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.441 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.53 HD12 ' CG1' ' A' ' 13' ' ' VAL . 12.6 mt -51.88 -39.58 59.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.278 -0.888 . . . . 0.0 109.736 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.581 HG12 ' CZ ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -74.26 -29.17 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.458 ' OD1' ' HG3' ' A' ' 46' ' ' GLU . 1.8 m-80 -88.77 -3.14 58.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.93 . . . . 0.0 109.599 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -102.33 -45.91 4.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.188 -0.945 . . . . 0.0 109.512 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' B' ' 4' ' ' GLU . 0.6 OUTLIER -106.14 -18.32 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.518 ' CD2' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -115.12 72.48 0.8 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.391 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -118.29 -7.82 10.67 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 109.502 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.89 -85.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.167 -0.958 . . . . 0.0 109.41 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -69.96 -30.89 68.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.298 -0.876 . . . . 0.0 109.345 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' GLU . 4.1 mp -77.05 -29.72 55.27 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.436 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 44' ' ' LEU . 8.9 pt-20 40.15 71.33 0.19 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.505 -0.747 . . . . 0.0 109.835 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' O ' ' CG ' ' A' ' 46' ' ' GLU . 1.3 tt0 44.14 46.17 7.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.924 . . . . 0.0 109.331 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.566 ' CD1' ' N ' ' A' ' 47' ' ' ILE . 0.9 OUTLIER 51.54 -147.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.237 -0.914 . . . . 0.0 109.161 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 47' ' ' ILE . 8.9 pttt 173.81 -49.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.97 . . . . 0.0 109.24 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.425 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -131.5 21.19 4.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.371 -0.831 . . . . 0.0 109.062 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.459 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mp0 65.48 59.62 0.78 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 0.0 109.32 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.7 -70.36 0.67 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.254 -0.904 . . . . 0.0 109.522 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.539 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 1.5 t -86.2 -21.13 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.313 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.526 ' CG1' ' HG3' ' A' ' 33' ' ' LYS . 89.8 t -76.63 -28.37 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.036 . . . . 0.0 109.114 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.459 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 28.9 t0 -90.16 -34.88 15.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.289 -0.882 . . . . 0.0 109.448 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -40.81 62.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.216 -0.928 . . . . 0.0 109.692 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.55 ' HB ' ' CD1' ' A' ' 60' ' ' LEU . 34.9 m -62.65 -49.44 83.75 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.075 -1.015 . . . . 0.0 109.622 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.561 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 13.2 tpp -41.98 -25.94 0.08 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.725 -1.234 . . . . 0.0 109.49 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.4 tm-20 -79.72 -50.95 9.84 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.071 -1.018 . . . . 0.0 109.935 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.566 ' CG2' ' N ' ' A' ' 60' ' ' LEU . 2.3 t -77.7 -52.88 8.25 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.899 -1.126 . . . . 0.0 109.782 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.566 ' N ' ' CG2' ' A' ' 59' ' ' THR . 20.4 mt -40.54 -52.67 2.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -71.96 113.28 8.83 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.376 -0.828 . . . . 0.0 109.557 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -110.26 25.73 11.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.335 -0.853 . . . . 0.0 109.38 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.0 -37.01 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.262 -0.898 . . . . 0.0 109.461 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 91.42 73.97 1.27 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.7 OUTLIER -177.39 30.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -1.154 . . . . 0.0 108.471 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.51 63.83 3.82 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.519 ' HB2' ' CD ' ' A' ' 26' ' ' LYS . 3.6 pt-20 -162.96 110.85 1.26 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.326 -1.103 . . . . 0.0 109.298 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 1.8 m -69.59 167.58 16.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.508 ' O ' ' HB3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -127.4 172.11 10.94 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.586 ' CZ ' ' CD1' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.18 -62.13 2.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.648 -1.282 . . . . 0.0 110.352 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.552 ' HA ' ' CB ' ' B' ' 78' ' ' ALA . 5.0 pt20 -48.08 -27.08 2.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.151 -0.968 . . . . 0.0 108.845 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -74.82 -42.8 57.36 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.633 -0.667 . . . . 0.0 109.695 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.624 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 32.4 t80 -54.02 -46.85 71.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.317 -0.864 . . . . 0.0 109.611 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.529 ' CB ' ' CB ' ' B' ' 78' ' ' ALA . 1.6 tpp -63.8 -54.63 32.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 109.336 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.426 ' HB3' ' HB1' ' B' ' 75' ' ' ALA . . . -64.46 -10.62 26.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.241 -0.912 . . . . 0.0 109.534 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.581 ' CZ ' HG12 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -74.39 -64.02 1.11 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.664 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.524 ' CG1' ' HE3' ' B' ' 74' ' ' MET . 87.0 t -58.2 -23.8 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.532 ' CB ' ' HB2' ' B' ' 74' ' ' MET . . . -66.67 -40.76 88.75 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.525 -0.734 . . . . 0.0 109.19 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.575 ' O ' ' N ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -77.75 -70.95 0.44 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.271 -0.893 . . . . 0.0 109.512 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.574 HG22 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -44.05 -24.67 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 120.502 -1.374 . . . . 0.0 110.035 -179.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.487 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.2 m -79.64 -66.73 0.84 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.919 -1.113 . . . . 0.0 108.433 178.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.547 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.9 m -78.4 -53.9 6.76 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.575 ' N ' ' O ' ' A' ' 79' ' ' MET . . . -36.88 -44.32 0.49 Allowed 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.259 0.552 . . . . 0.0 109.782 179.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.02 -47.43 65.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.564 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.27 -12.06 26.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.288 -0.883 . . . . 0.0 109.518 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -90.02 -31.86 17.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.42 ' O ' ' C ' ' A' ' 88' ' ' PHE . 0.2 OUTLIER -69.65 -27.78 65.34 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.454 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.453 ' CD1' ' O ' ' A' ' 89' ' ' GLU . 61.7 t80 -44.17 -66.99 0.32 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.428 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.453 ' O ' ' CD1' ' A' ' 88' ' ' PHE . 0.7 OUTLIER 44.43 -163.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.278 -0.889 . . . . 0.0 109.508 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -106.69 50.75 0.76 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 109.478 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.466 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.47 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.444 ' HA ' ' CB ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.19 -70.74 0.11 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.0 109.791 -179.797 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.505 ' N ' ' CD1' ' B' ' 3' ' ' LEU . 7.8 mp -74.64 -37.81 62.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.077 -1.014 . . . . 0.0 109.809 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.502 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -52.7 -62.39 1.68 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.952 . . . . 0.0 109.547 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -60.94 -47.72 85.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.292 -0.88 . . . . 0.0 109.646 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 6' ' ' ALA . . . -60.82 -13.8 17.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.239 -0.913 . . . . 0.0 109.627 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.406 ' O ' HD11 ' B' ' 11' ' ' ILE . 42.6 ttp -83.72 -49.34 9.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.51 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.479 HG11 ' N ' ' B' ' 9' ' ' ALA . 5.8 p -61.6 -34.28 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.285 -0.884 . . . . 0.0 109.648 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.479 ' N ' HG11 ' B' ' 8' ' ' VAL . . . -73.33 -60.25 2.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.538 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.574 HD11 ' CZ ' ' B' ' 73' ' ' PHE . 2.0 mm? -44.01 -49.54 8.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.42 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.406 HD11 ' O ' ' B' ' 7' ' ' MET . 13.6 mt -57.53 -47.97 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.233 -0.917 . . . . 0.0 109.548 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -51.34 -27.71 10.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.923 . . . . 0.0 109.474 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.543 HG12 ' CD1' ' B' ' 17' ' ' TYR . 2.1 t -84.79 -33.18 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.511 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 5.2 t80 -61.2 -49.11 78.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.882 -1.136 . . . . 0.0 109.471 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -78.06 -37.57 46.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.281 -0.887 . . . . 0.0 109.738 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 1.4 tp60 -60.07 -67.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.556 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.554 ' CE2' ' HG3' ' B' ' 34' ' ' GLU . 53.0 m-85 -57.99 -54.11 50.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 6.4 m -62.82 -12.7 26.28 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.0 109.589 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.88 -21.33 26.12 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.413 ' HB3' ' OE2' ' B' ' 21' ' ' GLU . 5.0 mmt180 -54.95 -47.04 75.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -1.117 . . . . 0.0 109.501 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.413 ' OE2' ' HB3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -168.83 147.98 4.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.491 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.77 -111.24 2.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.448 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -107.98 -78.76 0.58 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.204 -1.174 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER 168.56 -35.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 26.8 m80 -115.95 18.13 15.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.913 . . . . 0.0 109.429 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.468 ' HD2' ' HB2' ' B' ' 67' ' ' GLU . 30.5 mtmt -144.5 152.99 41.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.538 ' CG ' ' HB3' ' B' ' 31' ' ' GLU . 3.5 mp -93.59 142.77 26.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.129 -0.982 . . . . 0.0 109.739 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.589 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -98.78 86.29 3.49 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.365 -0.835 . . . . 0.0 109.099 179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 43.39 -86.18 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.43 -0.794 . . . . 0.0 110.826 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.589 ' N ' ' O ' ' B' ' 28' ' ' LYS . 39.1 t -47.82 -33.12 6.87 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.298 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.538 ' HB3' ' CG ' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -56.25 -44.25 79.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.795 -1.19 . . . . 0.0 109.216 -179.784 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.529 ' N ' HD21 ' B' ' 27' ' ' LEU . 5.2 mt -65.33 -52.82 51.32 Favored 'General case' 0 C--N 1.297 -1.712 0 O-C-N 121.479 -0.763 . . . . 0.0 109.124 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.509 ' HG2' ' CG1' ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.89 -64.27 0.61 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.39 -0.819 . . . . 0.0 109.884 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.554 ' HG3' ' CE2' ' B' ' 17' ' ' TYR . 5.0 pt-20 -47.34 -56.37 6.99 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.128 -0.983 . . . . 0.0 109.69 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.541 ' HG ' ' CD2' ' B' ' 17' ' ' TYR . 2.8 mt -43.51 -39.04 3.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.212 -0.93 . . . . 0.0 109.771 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.591 HG12 ' CZ ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -69.46 -52.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.252 -0.905 . . . . 0.0 109.529 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.442 ' OD1' HG13 ' B' ' 47' ' ' ILE . 40.5 m-80 -89.11 20.79 3.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 109.786 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 1.7 t30 -118.23 -36.12 3.65 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.973 . . . . 0.0 109.491 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.463 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 10.1 mm-40 -121.18 -14.27 8.39 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.23 -0.918 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.525 ' HB3' ' CD2' ' B' ' 44' ' ' LEU . 1.1 mt -113.25 52.97 0.77 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.3 t -111.73 37.87 2.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.71 -78.63 0.58 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.476 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -79.91 -46.17 17.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.525 ' CD2' ' HB3' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -92.58 54.01 2.18 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.236 -0.915 . . . . 0.0 109.553 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.29 71.2 10.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.252 -0.905 . . . . 0.0 109.433 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 0.3 OUTLIER -137.35 -88.41 0.27 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.588 ' O ' ' CB ' ' B' ' 48' ' ' LYS . 26.8 mm 66.66 -83.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.487 -0.758 . . . . 0.0 109.828 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.588 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 88.89 8.25 0.12 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.564 -0.71 . . . . 0.0 109.495 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.1 tt0 79.68 8.69 1.62 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.47 -0.769 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -176.19 21.25 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.73 -1.231 . . . . 0.0 111.475 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 51.5 tp10 -91.02 -70.74 0.67 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.488 -1.383 . . . . 0.0 109.331 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 1.2 t -93.56 -19.38 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.261 -0.899 . . . . 0.0 108.666 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.528 ' HA ' ' CG2' ' B' ' 56' ' ' VAL . 4.7 t -78.91 -20.44 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.369 -0.832 . . . . 0.0 109.233 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -85.1 -37.42 20.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.437 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -40.04 30.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 109.422 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.538 ' CG2' ' O ' ' B' ' 52' ' ' VAL . 34.1 m -63.9 -46.07 95.18 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 O-C-N 121.211 -0.931 . . . . 0.0 109.62 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.457 ' O ' ' HB2' ' B' ' 61' ' ' ASP . 4.9 tpt -41.87 -27.46 0.12 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.06 -1.025 . . . . 0.0 109.591 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.2 OUTLIER -84.5 -42.84 15.15 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.235 -0.916 . . . . 0.0 108.913 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.451 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.8 m -75.92 -63.99 1.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.353 -0.842 . . . . 0.0 109.753 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.534 ' CG ' ' HB ' ' B' ' 56' ' ' VAL . 3.8 mt -41.24 -39.43 1.35 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.461 ' OD2' ' HA2' ' B' ' 66' ' ' GLY . 50.2 m-20 -90.22 111.87 23.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.283 -0.885 . . . . 0.0 109.431 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' B' ' 72' ' ' GLU . 11.3 p-10 -95.99 -13.59 23.68 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.188 -0.945 . . . . 0.0 109.63 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.73 -22.01 13.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.612 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' B' ' 65' ' ' ASP . . . 80.68 99.82 0.33 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . 0.495 ' CB ' ' O ' ' B' ' 64' ' ' GLY . 0.5 OUTLIER 164.87 -26.16 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.25 -1.147 . . . . 0.0 108.608 -179.787 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . 0.462 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.56 23.44 5.97 Favored Glycine 0 N--CA 1.484 1.874 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' B' ' 67' ' ' GLU . 3.3 pt-20 -110.49 86.27 2.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.366 -1.079 . . . . 0.0 109.316 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.462 ' O ' ' HG2' ' B' ' 26' ' ' LYS . 13.1 t -69.9 156.24 39.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.214 -0.929 . . . . 0.0 109.78 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.457 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.3 OUTLIER -118.71 171.42 8.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.438 -0.789 . . . . 0.0 108.996 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.45 -51.57 67.92 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.228 -0.92 . . . . 0.0 110.335 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.466 ' HG3' ' HG2' ' B' ' 72' ' ' GLU . 16.7 pt20 -57.39 -37.97 73.52 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.411 -0.805 . . . . 0.0 109.222 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.466 ' HG2' ' HG3' ' B' ' 71' ' ' GLN . 1.8 mt-10 -79.3 -15.72 57.51 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.445 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.574 ' CZ ' HD11 ' B' ' 10' ' ' LEU . 5.8 t80 -71.05 -63.41 1.11 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 108.708 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.532 ' HB2' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -60.56 -37.78 82.39 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.426 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . . . -59.58 -37.35 78.29 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.627 ' CE2' ' CG2' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -57.59 -67.39 0.34 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.627 ' CG2' ' CE2' ' B' ' 76' ' ' PHE . 49.4 t -52.9 -21.95 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.552 ' CB ' ' HA ' ' A' ' 71' ' ' GLN . . . -57.42 -58.0 10.18 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.482 -0.761 . . . . 0.0 108.953 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 27.0 mmm -70.82 -65.56 0.72 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.433 -0.792 . . . . 0.0 109.284 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.567 HG22 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -41.5 -25.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.655 -1.278 . . . . 0.0 110.12 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.514 ' CG2' HD13 ' A' ' 11' ' ' ILE . 5.3 m -75.75 -70.13 0.45 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.886 -1.134 . . . . 0.0 108.673 178.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -79.11 -49.53 12.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.0 108.327 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.568 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -37.94 -44.0 0.75 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.249 0.547 . . . . 0.0 109.789 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.513 ' HB3' ' CB ' ' B' ' 44' ' ' LEU . 0.5 OUTLIER -90.22 -27.92 19.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.268 -0.895 . . . . 0.0 109.702 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.573 ' O ' ' CD1' ' B' ' 88' ' ' PHE . 81.4 t60 -70.81 -9.34 57.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 109.727 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -9.56 55.88 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.214 -0.929 . . . . 0.0 109.724 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -46.86 85.17 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.0 109.808 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.573 ' CD1' ' O ' ' B' ' 85' ' ' HIS . 0.2 OUTLIER -55.55 -23.29 25.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.699 -179.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.55 ' N ' ' CD1' ' B' ' 88' ' ' PHE . 0.2 OUTLIER 47.42 -174.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.0 109.449 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.63 165.4 6.76 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.918 . . . . 0.0 109.503 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.458 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.498 ' CG ' HG22 ' B' ' 13' ' ' VAL . 3.7 tt0 -62.03 -71.47 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -0.933 . . . . 0.0 109.493 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.526 ' HB3' ' CE ' ' A' ' 7' ' ' MET . 7.4 mp -71.98 -33.99 68.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.555 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.55 ' OE2' ' CE1' ' B' ' 42' ' ' HIS . 1.6 tt0 -54.13 -61.7 2.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.219 -0.926 . . . . 0.0 109.492 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -61.56 -47.19 86.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 179.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.52 ' O ' ' CD1' ' A' ' 10' ' ' LEU . . . -59.79 -15.28 19.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.279 -0.888 . . . . 0.0 109.375 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.565 ' CE ' ' CD1' ' B' ' 40' ' ' LEU . 2.9 tpp -82.25 -63.77 1.31 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.213 -0.929 . . . . 0.0 109.539 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.414 ' C ' ' O ' ' A' ' 7' ' ' MET . 19.1 t -44.27 -44.92 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.145 -0.972 . . . . 0.0 109.633 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.461 ' HA ' ' OE2' ' B' ' 2' ' ' GLU . . . -67.15 -60.14 2.86 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' CZ ' ' A' ' 73' ' ' PHE . 3.5 mt -47.66 -70.26 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.212 -0.93 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.535 HG12 ' CZ ' ' A' ' 70' ' ' PHE . 40.5 mt -41.65 -36.95 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.418 -0.801 . . . . 0.0 110.025 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.517 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 2.8 m-20 -60.6 -48.88 79.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.159 -0.963 . . . . 0.0 110.044 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.526 ' CG1' HD12 ' A' ' 35' ' ' LEU . 1.1 t -62.85 -28.55 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.483 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.4 t80 -67.51 -41.97 83.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.9 -1.125 . . . . 0.0 109.601 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -73.43 -34.35 65.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.29 -0.881 . . . . 0.0 110.019 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.517 ' CG ' ' O ' ' A' ' 12' ' ' ASP . 2.1 mt-30 -69.4 -63.31 1.09 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.062 -1.024 . . . . 0.0 109.678 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.581 ' CZ ' ' CD1' ' A' ' 35' ' ' LEU . 11.5 m-85 -49.88 -44.42 49.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.377 -0.827 . . . . 0.0 109.908 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -65.2 -32.84 74.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.146 -0.971 . . . . 0.0 109.52 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.21 -13.97 30.74 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.524 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 10.0 mtp85 -81.65 -32.84 31.69 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 109.527 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -79.42 134.01 36.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.286 -0.884 . . . . 0.0 109.434 179.993 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.43 -24.91 1.81 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.452 ' HB2' ' OE1' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -72.11 -46.52 56.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.239 -1.153 . . . . 0.0 109.487 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 18' ' ' SER . 1.2 mttm 66.94 60.33 0.53 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.92 . . . . 0.0 109.43 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.453 ' HB3' ' HD3' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -170.23 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.217 -0.927 . . . . 0.0 109.759 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -142.65 169.93 16.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.158 -0.964 . . . . 0.0 109.783 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.52 ' CD2' ' HB3' ' A' ' 31' ' ' GLU . 22.0 mt -97.55 163.12 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.29 -0.881 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -126.97 69.95 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.128 -0.983 . . . . 0.0 109.936 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 16.5 tptm 63.85 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.468 -0.77 . . . . 0.0 110.695 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.6 p -46.23 -41.42 12.85 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.146 -0.971 . . . . 0.0 110.273 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.52 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -62.28 -39.96 94.68 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.971 -1.08 . . . . 0.0 108.845 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 70.0 mt -58.21 -71.05 0.12 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.777 -0.577 . . . . 0.0 109.459 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.532 ' HE3' ' CG2' ' A' ' 53' ' ' VAL . 0.0 OUTLIER -43.89 -39.12 3.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.249 -0.907 . . . . 0.0 109.39 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -59.54 4.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.209 -0.932 . . . . 0.0 109.218 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' CD1' ' CZ ' ' A' ' 17' ' ' TYR . 13.4 tp -57.23 -55.54 33.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.418 -0.801 . . . . 0.0 109.404 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.529 ' CG2' HD12 ' A' ' 44' ' ' LEU . 2.2 mt -43.65 -29.0 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.36 -0.838 . . . . 0.0 109.254 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.506 ' ND2' ' O ' ' A' ' 45' ' ' GLU . 13.7 m120 -82.92 -40.63 19.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.251 -0.906 . . . . 0.0 109.812 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -95.31 21.22 8.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.187 -0.946 . . . . 0.0 109.777 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.537 ' OE1' ' CG2' ' A' ' 77' ' ' VAL . 22.8 pt-20 -129.52 -45.95 1.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.114 -0.992 . . . . 0.0 109.721 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.533 ' HB3' ' CB ' ' A' ' 43' ' ' PHE . 3.5 mp -76.67 -17.26 59.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.127 -0.983 . . . . 0.0 109.604 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 1.7 t 79.13 54.94 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.443 -0.786 . . . . 0.0 110.724 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.484 ' CB ' ' O ' ' A' ' 41' ' ' SER . 8.0 m-70 74.48 -4.11 2.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.16 -0.963 . . . . 0.0 110.447 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.533 ' CB ' ' HB3' ' A' ' 40' ' ' LEU . 1.6 t80 -56.94 -18.51 13.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.888 -1.133 . . . . 0.0 108.677 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.575 ' CD1' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -161.61 43.19 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.506 -0.746 . . . . 0.0 109.359 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 0.0 OUTLIER -43.92 -77.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.934 . . . . 0.0 109.509 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.9 OUTLIER -87.69 17.0 5.01 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.334 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.528 ' CG1' ' HD3' ' A' ' 33' ' ' LYS . 4.0 mt 60.17 120.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.3 -0.875 . . . . 0.0 109.39 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -44.69 -26.43 0.38 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.238 -0.914 . . . . 0.0 109.257 179.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER 172.96 49.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.314 -0.866 . . . . 0.0 109.271 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.513 ' N ' HG23 ' A' ' 47' ' ' ILE . 4.1 mp0 44.15 48.38 7.62 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.23 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -90.12 -53.55 4.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.912 -179.667 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.537 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 3.0 t -96.05 -20.21 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.129 -0.982 . . . . 0.0 110.041 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.532 ' CG2' ' HE3' ' A' ' 33' ' ' LYS . 37.1 t -81.5 -30.33 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.772 -1.205 . . . . 0.0 108.698 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.454 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -90.01 -24.4 21.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.405 -0.809 . . . . 0.0 108.848 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.8 OUTLIER -82.59 -48.42 11.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.38 -0.825 . . . . 0.0 109.208 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.567 HG23 ' CE1' ' A' ' 76' ' ' PHE . 33.0 m -57.6 -44.77 85.89 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 O-C-N 121.158 -0.964 . . . . 0.0 109.26 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.487 ' HE1' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -37.39 -30.87 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.483 -0.761 . . . . 0.0 109.632 -179.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.36 -44.99 12.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 56' ' ' VAL . 15.8 m -63.9 -65.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.651 ' CD1' ' CE2' ' A' ' 76' ' ' PHE . 3.3 mt -40.15 -66.76 0.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.444 -0.785 . . . . 0.0 109.602 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.435 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -45.76 94.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.45 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 60' ' ' LEU . 2.1 m-20 -109.62 -5.14 15.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.555 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -100.61 -39.79 7.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.206 -0.934 . . . . 0.0 109.383 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 68.92 0.83 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -168.76 25.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -1.153 . . . . 0.0 108.6 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.435 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 49.11 27.63 7.27 Favored Glycine 0 N--CA 1.482 1.705 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.458 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . 51.0 mm-40 -124.27 133.54 53.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.255 -1.144 . . . . 0.0 109.543 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 15.7 t -78.02 158.95 29.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.275 -0.891 . . . . 0.0 109.614 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.4 OUTLIER -127.21 171.63 11.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 108.877 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.592 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 0.1 OUTLIER -58.61 -54.02 51.77 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.293 -0.88 . . . . 0.0 110.488 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.46 ' HA ' ' HB2' ' B' ' 78' ' ' ALA . 1.2 pm0 -56.21 -29.71 61.31 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.093 -1.005 . . . . 0.0 108.887 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 6.8 mt-10 -80.13 -25.41 39.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 109.513 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.572 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 8.3 t80 -67.63 -55.65 12.46 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.307 -0.871 . . . . 0.0 108.83 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.515 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 8.9 mtt -61.34 -37.74 84.41 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.526 ' O ' ' CG ' ' A' ' 79' ' ' MET . . . -71.67 -19.9 62.02 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.47 -0.769 . . . . 0.0 109.018 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CE2' ' CD1' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -72.96 -69.56 0.41 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.792 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.537 ' CG2' ' OE1' ' A' ' 39' ' ' GLU . 42.0 t -54.61 -38.81 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.241 -0.912 . . . . 0.0 109.647 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.569 ' CB ' ' HB3' ' B' ' 74' ' ' MET . . . -65.76 -29.53 70.05 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.309 -0.869 . . . . 0.0 109.924 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.544 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 18.9 mmm -82.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.045 -1.034 . . . . 0.0 109.57 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.529 HG13 ' CD2' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -48.75 -20.81 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 O-C-N 120.399 -1.438 . . . . 0.0 109.709 -179.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.548 ' CG2' ' N ' ' A' ' 82' ' ' THR . 4.8 t -87.81 -50.93 6.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.795 -1.191 . . . . 0.0 109.371 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.586 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.2 t -90.32 -51.46 5.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.867 -1.145 . . . . 0.0 107.973 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.586 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -35.45 -37.04 0.08 Allowed 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.275 0.559 . . . . 0.0 109.946 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' A' ' 82' ' ' THR . 3.8 t -90.02 -38.04 13.88 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' A' ' 82' ' ' THR . 28.4 t60 -55.46 -18.33 6.86 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.222 -0.924 . . . . 0.0 109.489 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.512 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 0.8 OUTLIER -57.54 -41.56 81.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.516 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -62.76 -43.69 98.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.225 -0.922 . . . . 0.0 109.52 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -54.24 -64.28 0.88 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.169 -0.957 . . . . 0.0 109.476 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -125.09 108.73 12.1 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.24 -0.913 . . . . 0.0 109.545 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.512 ' CB ' ' O ' ' A' ' 86' ' ' GLU . 83.8 t60 -168.69 142.47 3.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.314 -0.866 . . . . 0.0 109.489 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.414 ' OXT' ' O ' ' A' ' 90' ' ' HIS . 9.8 mm-40 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.511 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' SER . . . . . 0.519 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 8.2 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.423 0.63 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . 0.473 ' HB3' HD23 ' B' ' 3' ' ' LEU . 1.6 tp10 -60.14 -63.26 1.36 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.838 . . . . 0.0 109.598 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.57 ' CD1' ' CD2' ' A' ' 10' ' ' LEU . 3.3 mm? -75.88 -34.83 60.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.63 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.519 ' HB2' ' N ' ' B' ' 1' ' ' SER . 2.7 mm-40 -53.45 -61.98 1.95 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.236 -0.915 . . . . 0.0 109.63 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -60.73 -48.06 83.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.23 -0.919 . . . . 0.0 109.546 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.526 ' CB ' HD13 ' A' ' 10' ' ' LEU . . . -61.11 -14.13 22.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.278 -0.889 . . . . 0.0 109.664 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.515 ' CE ' HG23 ' A' ' 81' ' ' THR . 1.6 mmt -83.05 -64.37 1.18 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 109.6 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -51.35 -25.81 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.493 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -75.89 -57.84 3.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.207 -0.933 . . . . 0.0 109.6 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -49.26 -39.31 30.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.215 -0.928 . . . . 0.0 109.639 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mt -70.46 -35.53 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.209 -0.932 . . . . 0.0 109.665 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 2.6 t70 -69.58 -16.17 63.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 0.0 109.638 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.582 HG13 ' CE2' ' B' ' 73' ' ' PHE . 1.5 t -89.99 -37.99 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.457 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' SG ' ' B' ' 68' ' ' CYS . 46.1 t80 -66.95 -42.08 85.86 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.866 -1.147 . . . . 0.0 109.341 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . 0.43 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -78.85 -49.79 12.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.497 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 30.1 tt0 -53.98 -59.69 4.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.0 109.504 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.585 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 45.5 m-85 -60.43 -47.57 85.55 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.233 -0.917 . . . . 0.0 109.62 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.49 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 97.6 p -61.77 -14.98 37.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.193 -0.942 . . . . 0.0 109.589 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.26 -31.27 66.32 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.444 ' HD2' ' HA ' ' B' ' 17' ' ' TYR . 1.4 mtt-85 -77.33 -10.9 59.72 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -1.128 . . . . 0.0 109.404 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -79.66 170.02 17.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.67 -35.51 35.95 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.513 ' CB ' ' HD2' ' B' ' 26' ' ' LYS . 2.5 t0 -75.38 -24.05 57.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -1.119 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' B' ' 23' ' ' ASP . 6.7 mttp 66.4 25.98 10.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.59 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . 0.516 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -160.69 22.93 0.14 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.558 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CE ' ' HB3' ' B' ' 25' ' ' HIS . 0.1 OUTLIER -168.67 169.03 10.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.24 -0.913 . . . . 0.0 109.513 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.579 ' CD2' ' HB3' ' B' ' 31' ' ' GLU . 7.7 mp -122.36 138.73 54.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.883 . . . . 0.0 109.786 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.537 ' CD ' ' OE2' ' B' ' 31' ' ' GLU . 0.2 OUTLIER -89.77 169.02 11.63 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.028 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.447 ' HA ' HD13 ' B' ' 32' ' ' LEU . 2.6 mtmt -42.14 -26.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.037 -1.04 . . . . 0.0 109.854 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.451 ' N ' ' O ' ' B' ' 28' ' ' LYS . 36.3 t -77.88 -51.92 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 110.97 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.579 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -58.16 -38.58 76.88 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.76 -1.212 . . . . 0.0 109.026 -179.377 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.574 ' CD2' ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -58.8 -67.28 0.38 Allowed 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.469 -0.769 . . . . 0.0 108.94 179.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.591 ' CD ' ' CD1' ' B' ' 47' ' ' ILE . 0.1 OUTLIER -41.08 -30.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.3 OUTLIER -63.75 -64.29 0.93 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.303 179.843 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.585 ' CD2' ' CD2' ' B' ' 17' ' ' TYR . 4.2 mm? -46.01 -40.32 10.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.33 -0.856 . . . . 0.0 109.65 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.566 HD12 ' CE1' ' B' ' 76' ' ' PHE . 1.7 mp -62.18 -41.82 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.068 -1.02 . . . . 0.0 109.945 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -82.14 -73.81 0.37 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.033 -1.042 . . . . 0.0 111.394 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . 0.468 ' OD1' ' OH ' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -68.18 -1.15 5.52 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.032 -1.043 . . . . 0.0 111.465 -178.071 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.544 ' CB ' ' O ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -131.03 -9.68 3.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.7 -1.25 . . . . 0.0 110.313 -179.92 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.565 ' CD1' ' CE ' ' A' ' 7' ' ' MET . 1.6 tp -141.48 78.3 1.63 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.705 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' SER . . . . . 0.427 ' O ' ' O ' ' B' ' 42' ' ' HIS . 0.1 OUTLIER -123.12 -19.89 5.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.151 -0.968 . . . . 0.0 109.739 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . 0.55 ' CE1' ' OE2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER -47.68 -92.09 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.136 -0.977 . . . . 0.0 109.297 -179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . 0.442 ' O ' ' SG ' ' B' ' 84' ' ' CYS . 33.0 m-85 -89.6 12.29 17.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.188 -0.945 . . . . 0.0 109.183 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.528 ' CD2' ' HG ' ' B' ' 40' ' ' LEU . 4.2 mm? -92.81 -36.35 12.91 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.341 -0.849 . . . . 0.0 109.451 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' B' ' 44' ' ' LEU . 49.4 mt-10 60.67 147.41 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' B' ' 48' ' ' LYS . 1.1 mm-40 -43.91 139.04 2.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.243 -0.911 . . . . 0.0 109.45 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.591 ' CD1' ' CD ' ' B' ' 33' ' ' LYS . 2.0 mt -43.86 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.334 -0.854 . . . . 0.0 109.12 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.472 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER -42.47 -31.85 0.48 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.753 -179.747 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.472 ' CG ' ' O ' ' B' ' 48' ' ' LYS . 0.9 OUTLIER 171.39 65.27 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.216 -0.928 . . . . 0.0 109.405 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.459 ' HB3' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 47.97 48.35 18.07 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.931 . . . . 0.0 109.193 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.438 ' OE1' ' HG3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.05 -64.1 1.19 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.541 ' CG1' ' CG1' ' B' ' 80' ' ' VAL . 1.3 t -90.83 -20.9 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.19 -0.944 . . . . 0.0 109.692 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.523 ' CG2' HD11 ' B' ' 47' ' ' ILE . 37.6 t -82.92 -31.35 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 120.803 -1.185 . . . . 0.0 108.993 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.459 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.54 -27.67 19.01 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.287 -0.883 . . . . 0.0 109.15 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -86.51 -46.09 10.49 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.333 -0.855 . . . . 0.0 109.447 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.531 ' CG1' ' O ' ' B' ' 52' ' ' VAL . 1.2 p -63.52 -41.41 92.56 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.037 -1.04 . . . . 0.0 108.904 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.516 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.49 -49.25 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.852 -0.53 . . . . 0.0 109.658 179.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -61.7 -44.85 96.14 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.448 ' O ' HG21 ' B' ' 59' ' ' THR . 34.2 m -65.74 -13.74 59.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.436 -0.79 . . . . 0.0 109.793 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.574 ' CD1' ' CD2' ' B' ' 32' ' ' LEU . 2.4 mt -87.17 -44.94 11.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.037 -1.039 . . . . 0.0 109.169 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' B' ' 57' ' ' MET . 8.3 m-20 -42.75 112.35 0.35 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.605 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -44.44 -45.58 9.16 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.31 -0.869 . . . . 0.0 109.611 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -155.18 19.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.169 -0.957 . . . . 0.0 109.762 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.13 95.5 2.28 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 t0 179.8 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.275 -1.132 . . . . 0.0 108.442 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 -21.21 28.94 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' B' ' 26' ' ' LYS . 5.3 mm-40 -69.88 108.1 3.84 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.233 -1.157 . . . . 0.0 109.29 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.556 ' SG ' ' CE1' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -69.69 128.1 35.26 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.215 -0.928 . . . . 0.0 109.727 -179.548 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.512 ' N ' ' OE1' ' B' ' 72' ' ' GLU . 9.1 m-20 -100.55 170.3 8.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.27 -0.894 . . . . 0.0 108.649 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.29 -59.37 5.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.757 -1.214 . . . . 0.0 110.148 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.493 ' HA ' ' HG2' ' B' ' 74' ' ' MET . 2.4 mt-30 -52.44 -24.69 8.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.046 -1.034 . . . . 0.0 109.084 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.537 ' CG ' ' HB3' ' B' ' 60' ' ' LEU . 0.1 OUTLIER -76.95 -38.15 53.85 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.349 -0.845 . . . . 0.0 109.389 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.582 ' CE2' HG13 ' B' ' 13' ' ' VAL . 24.7 t80 -68.46 -48.79 63.6 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.197 -0.939 . . . . 0.0 109.092 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.569 ' HB3' ' CB ' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -54.24 -46.48 72.58 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.307 -0.87 . . . . 0.0 109.337 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.505 ' N ' ' SD ' ' B' ' 74' ' ' MET . . . -74.73 -20.1 59.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.165 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.566 ' CE1' HD12 ' B' ' 36' ' ' ILE . 0.4 OUTLIER -72.73 -71.11 0.31 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 109.233 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.555 HG21 ' CE2' ' B' ' 76' ' ' PHE . 53.1 t -57.54 -31.29 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.111 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.515 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -59.76 -42.06 92.41 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.338 -0.851 . . . . 0.0 109.227 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.527 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 3.9 mmm -73.63 -70.06 0.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 0.0 109.618 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.541 ' CG1' ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.32 -25.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 120.891 -1.13 . . . . 0.0 109.591 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 11.8 m -70.96 -67.74 0.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.973 -1.079 . . . . 0.0 108.885 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.592 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 0.9 OUTLIER -82.98 -52.95 6.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.057 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' B' ' 79' ' ' MET . . . -36.09 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.261 0.553 . . . . 0.0 109.881 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' B' ' 82' ' ' THR . 41.4 t -72.78 -52.69 13.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.565 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -9.91 50.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.266 -0.896 . . . . 0.0 109.583 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -81.85 -20.15 39.55 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.24 -0.912 . . . . 0.0 109.48 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.453 ' O ' ' CG ' ' B' ' 89' ' ' GLU . 0.2 OUTLIER -58.83 -38.24 78.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.489 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.46 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 0.2 OUTLIER -54.84 -33.41 61.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.46 ' CB ' ' O ' ' B' ' 88' ' ' PHE . 3.4 mt-10 73.54 91.98 0.08 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.294 -0.879 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 89' ' ' GLU . 2.1 m80 55.37 169.77 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.46 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 118.0 -1.0 . . . . 0.0 109.453 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.484 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.515 ' HG3' ' CB ' ' B' ' 9' ' ' ALA . 3.0 tt0 -64.32 -50.41 67.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.896 . . . . 0.0 109.468 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.524 ' O ' ' CB ' ' A' ' 7' ' ' MET . 1.2 mp -79.94 -27.5 39.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.57 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.512 ' N ' ' HG3' ' B' ' 39' ' ' GLU . 37.7 tt0 -60.99 -50.54 72.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 109.525 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -52.88 15.62 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.297 -0.877 . . . . 0.0 109.251 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.588 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -61.9 -13.26 23.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.926 . . . . 0.0 109.504 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.524 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 42.3 ttp -80.09 -59.08 2.85 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.219 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 75.9 t -57.09 -24.51 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.224 -0.923 . . . . 0.0 109.266 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.11 -51.82 9.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' ' CD1' ' B' ' 3' ' ' LEU . 0.4 OUTLIER -57.53 -60.66 3.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 109.426 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.568 HG12 ' CZ ' ' A' ' 70' ' ' PHE . 6.9 mt -53.06 -43.97 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.274 -0.891 . . . . 0.0 109.227 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 9.3 m-20 -54.16 -37.18 64.16 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.375 -0.828 . . . . 0.0 109.247 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.573 HG23 ' CE1' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -66.29 -39.77 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.18 -0.95 . . . . 0.0 109.188 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -53.74 -62.85 1.38 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.985 -1.072 . . . . 0.0 108.286 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -66.19 -10.04 37.61 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.291 -0.881 . . . . 0.0 109.13 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.498 ' HB3' ' CD1' ' A' ' 17' ' ' TYR . 1.7 tp60 -67.26 -66.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 109.91 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -125.05 35.35 4.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.697 -1.252 . . . . 0.0 110.708 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.587 ' HA ' ' CD2' ' A' ' 27' ' ' LEU . 37.6 m -91.4 -22.36 20.51 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.922 -1.111 . . . . 0.0 109.201 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.47 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -103.36 20.72 41.6 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -60.42 -61.91 2.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -1.132 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -122.87 164.83 17.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.431 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.39 -128.62 11.63 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.548 ' CB ' ' NE2' ' A' ' 25' ' ' HIS . 3.9 m-20 -88.99 -148.81 0.18 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -1.144 . . . . 0.0 109.46 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.47 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 14.9 ttpt -145.04 65.81 1.26 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 109.476 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.548 ' NE2' ' CB ' ' A' ' 23' ' ' ASP . 2.8 p80 -170.33 -34.22 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.227 -0.921 . . . . 0.0 109.969 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.522 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -125.46 170.4 11.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.135 -0.978 . . . . 0.0 110.006 -179.524 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.587 ' CD2' ' HA ' ' A' ' 18' ' ' SER . 8.1 mt -104.19 170.52 7.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.425 -0.797 . . . . 0.0 109.929 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -133.54 69.89 1.47 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.317 -0.864 . . . . 0.0 109.667 179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 65.21 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.59 -0.694 . . . . 0.0 111.064 179.121 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 m -46.14 -42.32 13.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 110.594 -178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.545 ' CB ' ' HB3' ' A' ' 27' ' ' LEU . 6.8 mm-40 -59.86 -40.31 88.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.932 -1.105 . . . . 0.0 108.919 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.581 ' HB3' ' CE2' ' A' ' 76' ' ' PHE . 1.5 mp -55.76 -60.18 3.81 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.528 ' CB ' ' OD1' ' A' ' 37' ' ' ASN . 9.1 mttt -41.56 -50.97 4.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.237 -0.914 . . . . 0.0 109.93 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 38' ' ' ASN . 0.2 OUTLIER -60.23 -39.42 86.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.998 -1.064 . . . . 0.0 110.126 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.633 ' CD2' ' CE2' ' A' ' 17' ' ' TYR . 3.8 mm? -52.71 -56.58 14.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.463 -0.773 . . . . 0.0 110.263 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.629 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 1.9 mp -94.29 -57.02 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 120.93 -1.106 . . . . 0.0 109.788 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.579 ' ND2' ' CD1' ' A' ' 47' ' ' ILE . 1.6 m120 -43.96 -26.19 0.26 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.162 -0.961 . . . . 0.0 109.565 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 34' ' ' GLU . 5.4 t30 -99.82 -41.91 7.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.151 -0.968 . . . . 0.0 109.627 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.524 ' CG ' ' O ' ' A' ' 35' ' ' LEU . 58.0 mm-40 -72.05 -62.78 1.31 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.514 HD12 ' CG2' ' A' ' 36' ' ' ILE . 5.9 mp -41.71 -65.74 0.42 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.394 -0.817 . . . . 0.0 109.57 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 t 51.21 21.54 1.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.447 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 8.5 t60 -153.01 -73.98 0.13 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.272 -0.893 . . . . 0.0 109.515 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.462 ' HB3' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -44.11 -26.5 0.3 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.23 -0.919 . . . . 0.0 109.499 -179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.502 ' CD1' ' O ' ' A' ' 44' ' ' LEU . 0.9 OUTLIER -167.52 76.82 0.16 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -44.02 111.58 0.31 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.225 -0.922 . . . . 0.0 109.418 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 35.0 mt-10 60.93 -164.13 0.24 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.882 . . . . 0.0 109.381 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.579 ' CD1' ' ND2' ' A' ' 37' ' ' ASN . 45.0 mm -127.66 74.26 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.197 -0.939 . . . . 0.0 109.563 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -42.8 -44.09 4.28 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.417 -0.802 . . . . 0.0 109.342 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.49 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 0.4 OUTLIER -127.47 153.13 46.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.379 -0.826 . . . . 0.0 109.126 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.475 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 1.6 pt20 -85.76 55.55 3.57 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.28 -0.888 . . . . 0.0 109.413 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.52 -45.6 8.84 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 109.954 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.538 ' O ' ' CG1' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -98.66 -25.78 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.035 . . . . 0.0 110.076 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.544 ' CG2' HG13 ' A' ' 47' ' ' ILE . 52.0 t -81.92 -24.73 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.812 -1.18 . . . . 0.0 109.354 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -90.23 -37.06 14.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.167 -0.958 . . . . 0.0 108.916 179.247 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -78.26 -47.39 18.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.426 -0.796 . . . . 0.0 109.268 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.567 HG13 ' CE1' ' A' ' 76' ' ' PHE . 2.9 p -59.12 -44.33 91.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.519 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 10.7 tpt -41.8 -48.76 4.36 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.603 -0.686 . . . . 0.0 109.949 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -57.16 -56.35 22.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.183 -0.948 . . . . 0.0 109.422 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.409 ' O ' ' CG2' ' A' ' 59' ' ' THR . 7.8 m -66.54 -8.67 28.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.306 -0.871 . . . . 0.0 109.574 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.552 HD23 ' CA ' ' A' ' 76' ' ' PHE . 63.7 mt -96.15 -17.29 20.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 -179.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 62' ' ' ASN . 8.9 m-20 -59.1 113.37 2.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.167 -0.958 . . . . 0.0 109.393 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' OD1' ' OD2' ' A' ' 69' ' ' ASP . 14.5 t30 -43.5 -47.75 7.25 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 109.535 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -165.84 40.86 0.06 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.41 87.8 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.7 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.311 -1.111 . . . . 0.0 108.632 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 -19.22 27.56 Favored Glycine 0 N--CA 1.485 1.94 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.514 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 1.3 mt-10 -71.79 103.2 3.04 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -1.149 . . . . 0.0 109.41 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' CYS . . . . . 0.541 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -70.05 137.02 50.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.303 -0.873 . . . . 0.0 109.258 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 6.5 m-20 -116.85 170.56 8.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.416 -0.803 . . . . 0.0 109.163 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.568 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -52.08 -50.42 61.59 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.056 -1.028 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.499 ' O ' ' HG3' ' A' ' 74' ' ' MET . 0.0 OUTLIER -48.49 -35.73 13.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 109.155 -179.716 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.541 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -78.53 -31.84 47.72 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.969 -1.082 . . . . 0.0 109.369 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -53.55 -51.48 62.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.977 -1.077 . . . . 0.0 108.966 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.537 ' HG2' ' CB ' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -67.13 -38.36 85.42 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.401 -0.812 . . . . 0.0 109.353 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.534 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -68.47 -15.76 63.66 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.081 -1.012 . . . . 0.0 108.866 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.629 ' CD2' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -82.7 -72.29 0.45 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.388 -0.82 . . . . 0.0 109.216 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.501 HG22 ' CD2' ' B' ' 3' ' ' LEU . 54.1 t -54.28 -32.92 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 O-C-N 121.226 -0.921 . . . . 0.0 108.921 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -65.38 -42.02 93.14 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.508 -0.745 . . . . 0.0 109.849 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.555 ' O ' ' CB ' ' A' ' 83' ' ' ALA . 41.6 mmm -77.53 -71.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.914 -1.116 . . . . 0.0 110.089 -179.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.583 HG23 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -45.07 -23.14 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 O-C-N 120.436 -1.415 . . . . 0.0 109.83 -178.682 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.492 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 18.5 m -80.77 -66.28 0.9 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.816 -1.178 . . . . 0.0 108.643 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.75 -50.2 10.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 108.596 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.573 ' N ' ' CG2' ' A' ' 82' ' ' THR . . . -38.38 -41.51 0.64 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.758 -0.589 . . . . 0.0 109.739 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 16.4 t -63.78 -49.51 72.66 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.262 -0.899 . . . . 0.0 109.598 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.51 -21.67 64.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.522 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -90.04 -21.98 22.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -67.3 0.26 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.53 ' O ' ' CG ' ' A' ' 89' ' ' GLU . 38.7 m-85 -57.56 -69.37 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.253 -0.904 . . . . 0.0 109.471 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.53 ' CG ' ' O ' ' A' ' 88' ' ' PHE . 10.9 pt-20 41.84 29.14 0.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.487 -0.758 . . . . 0.0 109.642 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' N ' ' O ' ' A' ' 88' ' ' PHE . 11.5 m-70 -76.19 153.47 36.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.452 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -76.34 0.09 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 0.0 109.49 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.523 ' O ' ' CB ' ' B' ' 7' ' ' MET . 2.8 mp -62.48 -15.75 51.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.918 . . . . 0.0 109.431 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -73.01 -69.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.402 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -58.97 -49.57 77.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 109.322 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' B' ' 7' ' ' MET . . . -54.89 -56.42 19.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.325 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' MET . . . . . 0.523 ' CB ' ' O ' ' B' ' 3' ' ' LEU . 15.5 ttp -43.83 -39.0 3.59 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.385 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . 0.402 ' HB ' ' O ' ' B' ' 5' ' ' LYS . 87.0 t -61.28 -48.86 87.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.425 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . 0.515 ' CB ' ' HG3' ' A' ' 2' ' ' GLU . . . -62.02 -61.48 2.45 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.565 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' LEU . . . . . 0.588 ' CD2' ' CB ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -43.43 -39.12 3.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.312 -0.867 . . . . 0.0 109.489 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.457 HG12 ' O ' ' B' ' 7' ' ' MET . 13.5 mm -61.66 -51.51 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.128 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 6.9 t0 -58.95 -17.06 21.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.321 -0.862 . . . . 0.0 109.229 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.557 ' CG1' ' CD2' ' B' ' 35' ' ' LEU . 1.3 t -76.5 -53.18 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.286 -0.884 . . . . 0.0 109.166 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.8 t80 -55.1 -50.98 67.84 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.812 -1.18 . . . . 0.0 109.384 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -63.84 1.0 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.166 -0.959 . . . . 0.0 109.93 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' B' ' 17' ' ' TYR . 0.9 OUTLIER -45.31 -68.73 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.806 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.574 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 23.4 m-85 -42.73 -34.12 0.86 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.384 -0.822 . . . . 0.0 109.722 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' SER . . . . . 0.536 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -85.69 50.0 1.88 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.19 -0.944 . . . . 0.0 109.294 179.762 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.61 -44.3 1.7 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -23.06 21.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.326 -1.103 . . . . 0.0 109.456 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER -69.84 102.47 1.95 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.213 -0.929 . . . . 0.0 109.504 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . 44.1 -95.84 0.01 OUTLIER Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' B' ' 21' ' ' GLU . 0.4 OUTLIER -112.49 -81.23 0.59 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -1.157 . . . . 0.0 109.411 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' B' ' 18' ' ' SER . 0.1 OUTLIER 175.77 56.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.261 -0.899 . . . . 0.0 109.378 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -136.88 6.63 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.189 -0.944 . . . . 0.0 109.7 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -170.1 170.53 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.126 -0.984 . . . . 0.0 109.689 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.472 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 26.1 mt -126.54 130.74 51.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.235 -0.915 . . . . 0.0 110.122 -179.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' C ' ' B' ' 29' ' ' LYS . 3.2 ttmt -69.67 154.03 42.57 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.477 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -39.45 -32.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.314 -0.866 . . . . 0.0 109.718 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.8 OUTLIER -76.31 -46.58 27.09 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.322 -0.861 . . . . 0.0 109.481 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.472 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -52.67 -42.96 65.21 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.179 -0.951 . . . . 0.0 108.988 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.611 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 5.6 mt -60.3 -66.32 0.54 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.648 -0.657 . . . . 0.0 109.306 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.462 ' O ' ' ND2' ' B' ' 37' ' ' ASN . 0.6 OUTLIER -42.88 -27.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 109.364 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -66.53 -51.59 54.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -0.873 . . . . 0.0 109.329 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . 0.574 ' HG ' ' CE1' ' B' ' 17' ' ' TYR . 2.3 mp -56.77 -42.12 78.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.263 -0.898 . . . . 0.0 109.475 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.555 HD12 ' CZ ' ' B' ' 76' ' ' PHE . 3.4 mt -79.91 -14.13 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.268 -0.895 . . . . 0.0 109.563 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' B' ' 33' ' ' LYS . 0.9 OUTLIER -89.38 -14.73 34.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 109.533 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -99.69 -35.43 9.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 0.0 109.507 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.512 ' HG3' ' N ' ' A' ' 4' ' ' GLU . 3.2 tm-20 -110.31 -10.01 14.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.505 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.524 ' CD2' ' HA ' ' B' ' 81' ' ' THR . 0.3 OUTLIER -131.6 68.08 1.5 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.233 -0.917 . . . . 0.0 109.58 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.99 -9.99 13.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.09 -44.28 2.92 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.902 . . . . 0.0 109.465 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.24 -47.94 46.09 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.251 -0.906 . . . . 0.0 109.404 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . 0.467 HD22 HD21 ' B' ' 40' ' ' LEU . 0.4 OUTLIER -117.11 40.66 2.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.904 . . . . 0.0 109.353 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 45.44 -150.07 0.07 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.214 -0.929 . . . . 0.0 109.431 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -85.22 45.04 1.14 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.399 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' ILE . . . . . 0.53 HG23 ' CG2' ' B' ' 53' ' ' VAL . 9.0 mm 60.99 20.85 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.295 -0.878 . . . . 0.0 109.568 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.4 mttt 43.81 32.68 0.62 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.124 -0.985 . . . . 0.0 109.382 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 50.8 tt0 83.14 -43.1 0.11 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.63 -0.668 . . . . 0.0 109.878 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.496 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.8 OUTLIER 176.22 56.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.0 109.645 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . 0.404 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 2.2 tm-20 -90.55 -69.7 0.71 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -0.932 . . . . 0.0 109.529 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.551 ' O ' ' CG2' ' B' ' 56' ' ' VAL . 17.0 t -85.56 -22.22 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.196 -0.94 . . . . 0.0 109.688 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.53 ' CG2' HG23 ' B' ' 47' ' ' ILE . 47.8 t -78.86 -36.02 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.147 -0.97 . . . . 0.0 109.366 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.496 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 23.7 t70 -76.58 -35.66 58.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.252 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -73.53 -45.68 52.22 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.879 . . . . 0.0 109.385 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' VAL . . . . . 0.618 ' CG2' ' CZ ' ' B' ' 76' ' ' PHE . 25.9 m -59.77 -43.36 91.5 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.147 -0.97 . . . . 0.0 109.69 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' MET . . . . . 0.45 ' C ' ' O ' ' B' ' 56' ' ' VAL . 0.0 OUTLIER -41.62 -28.11 0.12 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.972 -1.08 . . . . 0.0 109.419 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.6 tm-20 -83.63 -46.25 12.55 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' THR . . . . . 0.477 ' O ' ' C ' ' B' ' 60' ' ' LEU . 7.5 m -68.76 -65.12 0.74 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 109.054 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . 0.633 ' CD1' ' CD2' ' B' ' 76' ' ' PHE . 21.0 mt -36.44 -62.58 0.45 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.81 -0.556 . . . . 0.0 109.693 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . 0.463 ' OD1' ' HA2' ' B' ' 64' ' ' GLY . 5.1 t70 -56.62 98.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.402 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.455 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 3.1 m120 -96.33 -11.17 26.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -105.45 -40.67 5.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -0.922 . . . . 0.0 109.479 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . 0.463 ' HA2' ' OD1' ' B' ' 61' ' ' ASP . . . 101.82 95.39 2.26 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 176.71 -32.48 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.211 -1.17 . . . . 0.0 108.61 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 12.82 16.85 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . 0.521 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 20.0 pt-20 -110.39 116.51 31.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.24 -1.153 . . . . 0.0 109.337 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' CYS . . . . . 0.472 ' O ' ' HA ' ' B' ' 26' ' ' LYS . 9.0 t -73.04 152.77 41.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.2 -0.937 . . . . 0.0 109.765 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . 0.452 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -115.38 171.8 7.48 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -55.34 -51.46 66.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.123 -0.986 . . . . 0.0 110.305 -179.669 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . 0.459 ' OE1' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -59.98 -36.33 76.93 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.314 -0.867 . . . . 0.0 108.975 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.459 ' HG2' ' OE1' ' B' ' 71' ' ' GLN . 3.4 mt-10 -79.82 -13.12 59.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.091 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.567 ' CE2' ' SD ' ' B' ' 74' ' ' MET . 0.0 OUTLIER -73.88 -60.35 2.3 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.654 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' MET . . . . . 0.567 ' SD ' ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -67.78 -24.43 65.32 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.524 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -70.14 -30.54 67.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.301 -0.874 . . . . 0.0 108.731 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.647 ' CD1' ' CG2' ' B' ' 80' ' ' VAL . 0.8 OUTLIER -75.71 -69.02 0.51 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.226 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.482 ' O ' ' CB ' ' B' ' 81' ' ' THR . 42.9 t -49.22 -36.12 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.321 -0.862 . . . . 0.0 109.408 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . 0.537 ' CB ' ' HG2' ' A' ' 74' ' ' MET . . . -66.17 -38.39 87.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.873 . . . . 0.0 110.438 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 83' ' ' ALA . 58.5 mtm -78.2 -71.35 0.43 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.888 -1.133 . . . . 0.0 109.795 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' VAL . . . . . 0.647 ' CG2' ' CD1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -45.41 -23.49 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 O-C-N 120.452 -1.405 . . . . 0.0 109.585 -179.13 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' THR . . . . . 0.524 ' HA ' ' CD2' ' B' ' 40' ' ' LEU . 11.8 m -79.09 -67.27 0.77 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.926 -1.109 . . . . 0.0 108.678 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' THR . . . . . 0.58 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.2 t -80.71 -50.74 9.5 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.206 -0.934 . . . . 0.0 108.615 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . 0.58 ' N ' ' CG2' ' B' ' 82' ' ' THR . . . -38.01 -31.21 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.331 0.586 . . . . 0.0 109.657 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' B' ' 82' ' ' THR . 48.2 t -85.25 -43.59 13.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 0.0 109.516 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' B' ' 82' ' ' THR . 54.4 t-80 -48.07 -33.51 8.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.523 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' B' ' 87' ' ' PHE . 2.0 tt0 -87.97 -28.36 21.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.525 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.434 ' HB2' ' HA ' ' B' ' 84' ' ' CYS . 0.2 OUTLIER -44.05 -50.58 8.36 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -52.37 -67.51 0.25 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.223 -0.923 . . . . 0.0 109.405 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 176.34 4.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.93 136.74 17.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.275 -0.89 . . . . 0.0 109.497 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.416 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' B' ' 39' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.685 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -71.88 -59.92 2.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.446 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -72.31 -23.96 61.25 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.455 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.44 ' HB3' ' N ' ' A' ' 1' ' ' SER . 10.6 tm-20 -62.77 -61.25 2.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -41.9 94.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.226 -0.921 . . . . 0.0 109.326 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.89 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -66.91 -19.07 65.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.264 -0.898 . . . . 0.0 109.42 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.66 ' O ' HD12 ' A' ' 11' ' ' ILE . 2.2 mtp -76.32 -44.13 38.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.401 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 8' ' ' VAL . 3.5 t -65.94 -38.18 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.501 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -75.04 -65.67 0.85 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.481 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.983 HD11 ' HB1' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -43.76 -41.24 4.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.448 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.66 HD12 ' O ' ' A' ' 7' ' ' MET . 61.9 mt -62.19 -45.23 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -56.99 -27.37 61.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.227 -0.921 . . . . 0.0 109.357 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.037 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -80.01 -28.7 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.266 -0.897 . . . . 0.0 109.068 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 34.4 t80 -66.33 -45.69 79.4 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.055 -1.028 . . . . 0.0 109.45 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 8.1 m-70 -80.32 -34.55 36.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.597 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.14 -63.38 1.26 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.494 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.501 ' HE1' HG22 ' A' ' 13' ' ' VAL . 43.8 m-85 -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.543 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 82.9 p -61.18 -21.09 63.48 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.288 -0.883 . . . . 0.0 109.486 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.482 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -66.73 -31.99 80.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.3 mmt180 -52.51 -41.56 63.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -1.132 . . . . 0.0 109.477 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 23' ' ' ASP . 43.6 tt0 -76.6 81.89 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.451 ' O ' ' O ' ' A' ' 23' ' ' ASP . . . 43.63 -95.23 0.01 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -57.91 -158.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -1.133 . . . . 0.0 109.448 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.8 pttp -153.93 89.79 1.33 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 109.412 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.564 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -169.05 -36.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.543 ' N ' ' HB2' ' A' ' 18' ' ' SER . 0.0 OUTLIER -122.74 170.11 10.39 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 109.557 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.872 HD23 ' C ' ' A' ' 31' ' ' GLU . 2.9 mp -110.4 143.65 40.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.274 -0.891 . . . . 0.0 109.503 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 30' ' ' SER . 1.5 tttp -98.56 84.64 3.2 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.301 -0.875 . . . . 0.0 109.282 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' A' ' 30' ' ' SER . 29.1 ttmt 43.17 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.425 -0.797 . . . . 0.0 110.847 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' A' ' 28' ' ' LYS . 2.0 t -47.61 -31.89 4.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.156 -0.965 . . . . 0.0 110.06 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.872 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -58.85 -45.62 89.63 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.832 -1.168 . . . . 0.0 108.64 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.933 HD11 ' SG ' ' A' ' 68' ' ' CYS . 27.1 mt -58.65 -54.95 41.25 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' HG21 ' A' ' 53' ' ' VAL . 1.2 tttt -46.31 -42.46 14.69 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.386 -0.821 . . . . 0.0 109.391 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -58.47 7.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.037 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.23 -40.25 58.4 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.335 -0.853 . . . . 0.0 109.663 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.628 HD13 HG22 ' A' ' 53' ' ' VAL . 48.0 mt -61.75 -36.33 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.203 -0.936 . . . . 0.0 109.951 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLU . 6.8 m120 -94.92 -71.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.085 -1.01 . . . . 0.0 109.779 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 37' ' ' ASN . 2.6 t-20 -41.53 -27.08 0.08 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.421 -0.799 . . . . 0.0 110.111 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.978 ' HG3' HD23 ' A' ' 35' ' ' LEU . 1.6 mm-40 -112.03 -46.14 3.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.09 -1.006 . . . . 0.0 109.726 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 9.3 mp -106.9 61.97 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.103 -0.998 . . . . 0.0 109.582 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.218 -0.926 . . . . 0.0 109.409 179.886 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.578 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 1.1 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.568 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 12.5 mttt 83.59 -44.58 0.11 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.553 -0.717 . . . . 0.0 109.367 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 60.9 mm-40 -110.32 14.69 22.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.238 -0.914 . . . . 0.0 109.03 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.536 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.4 mt-30 78.34 59.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.711 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 3.7 mp0 -90.08 -70.6 0.66 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.215 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.837 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t -91.44 -21.18 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.126 -0.984 . . . . 0.0 108.629 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.628 HG22 HD13 ' A' ' 36' ' ' ILE . 55.2 t -73.22 -30.73 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.368 -0.832 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -90.09 -40.42 12.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.405 -0.809 . . . . 0.0 109.113 179.624 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -64.41 -35.5 81.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.326 -0.859 . . . . 0.0 109.272 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.837 HG13 ' O ' ' A' ' 52' ' ' VAL . 4.4 m -55.38 -56.54 11.17 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.263 -0.898 . . . . 0.0 109.716 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.645 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -41.49 -28.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.001 -1.062 . . . . 0.0 109.626 -179.768 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.1 tp10 -69.59 -55.99 8.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.285 -0.884 . . . . 0.0 108.788 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.468 ' O ' ' C ' ' A' ' 60' ' ' LEU . 9.6 m -81.28 -61.68 1.88 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 108.877 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.721 HD13 ' HB ' ' A' ' 56' ' ' VAL . 6.5 mp -37.82 -36.43 0.19 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.695 -0.628 . . . . 0.0 109.79 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 57' ' ' MET . 28.0 t0 -89.98 95.73 10.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.213 -0.93 . . . . 0.0 109.433 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -109.69 11.23 24.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.248 -0.908 . . . . 0.0 109.498 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -120.97 -30.21 4.44 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.518 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.33 90.77 0.56 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.87 -32.47 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.271 -1.135 . . . . 0.0 108.618 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.2 31.15 Favored Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.471 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 21.9 mt-10 -88.25 107.12 18.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -1.166 . . . . 0.0 109.402 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.933 ' SG ' HD11 ' A' ' 32' ' ' LEU . 4.3 m -69.82 143.58 52.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.256 -0.902 . . . . 0.0 109.797 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.0 m-20 -116.62 169.5 9.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.492 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -51.0 -47.48 61.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.233 -0.917 . . . . 0.0 110.072 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.577 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 16.6 mt-30 -47.92 -42.09 26.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.44 -0.787 . . . . 0.0 109.582 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.57 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.03 -25.02 43.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.163 -0.961 . . . . 0.0 109.979 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.457 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 10.4 t80 -59.3 -58.32 9.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.069 -1.019 . . . . 0.0 109.407 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.921 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -68.36 -49.73 58.15 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.233 -0.917 . . . . 0.0 109.46 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB3' ' A' ' 78' ' ' ALA . . . -54.96 -23.47 19.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.117 -0.99 . . . . 0.0 108.973 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.815 ' CE1' HG21 ' A' ' 80' ' ' VAL . 2.2 t80 -70.3 -63.67 1.04 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HG23 ' A' ' 80' ' ' VAL . 3.3 t -52.91 -23.57 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' B' ' 74' ' ' MET . . . -62.33 -54.23 43.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.421 -0.799 . . . . 0.0 108.865 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 1.4 mmm -70.52 -69.44 0.36 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.379 -0.825 . . . . 0.0 109.479 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.815 HG21 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.03 -25.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 120.567 -1.333 . . . . 0.0 110.129 -179.416 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.2 m -76.36 -69.98 0.47 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.919 -1.113 . . . . 0.0 108.512 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.572 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.6 t -78.04 -49.91 13.09 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.95 -47.75 1.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.2 t -61.27 -47.12 87.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.471 -0.768 . . . . 0.0 109.286 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -9.93 51.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.25 -0.906 . . . . 0.0 109.488 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 87' ' ' PHE . 0.8 OUTLIER -82.68 -21.06 35.05 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.313 -0.867 . . . . 0.0 109.498 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 O-C-N 121.25 -0.906 . . . . 0.0 109.486 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.532 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 3' ' ' LEU . 1.3 tp10 -70.38 -55.35 9.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.719 HD21 HG11 ' A' ' 13' ' ' VAL . 3.1 mm? -75.44 -27.64 59.02 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 0.0 109.39 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.532 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 2.8 tm-20 -67.15 -61.55 1.87 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.82 -49.3 71.37 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.92 . . . . 0.0 109.41 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.983 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -65.02 -22.59 67.02 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.289 -0.882 . . . . 0.0 109.453 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.48 ' HG2' HD12 ' B' ' 11' ' ' ILE . 5.3 ttt -68.95 -42.61 76.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.427 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.8 t -70.34 -34.16 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.217 -0.927 . . . . 0.0 109.433 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.685 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -65.73 -64.46 0.86 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.243 -0.911 . . . . 0.0 109.472 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.804 HD22 ' SD ' ' B' ' 74' ' ' MET . 0.4 OUTLIER -50.74 -47.94 59.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.473 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 88.7 mt -56.42 -36.0 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.179 -0.951 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.7 OUTLIER -67.6 -29.85 69.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.244 -0.91 . . . . 0.0 109.439 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 1.072 HG13 HD11 ' B' ' 35' ' ' LEU . 10.8 t -75.72 -25.02 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.4 t80 -74.69 -50.95 15.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.996 -1.065 . . . . 0.0 109.478 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.446 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 15.6 m80 -78.28 -20.82 50.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.25 -0.906 . . . . 0.0 109.832 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 53.3 tt0 -83.13 -60.29 2.2 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.139 -0.976 . . . . 0.0 109.565 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.648 ' CD2' HD13 ' B' ' 35' ' ' LEU . 28.0 m-85 -63.32 -28.18 69.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.889 . . . . 0.0 109.541 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' B' ' 25' ' ' HIS . 84.6 p -71.09 -20.48 62.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.189 -0.945 . . . . 0.0 109.69 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.96 30.28 10.71 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.14 -59.49 2.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -1.144 . . . . 0.0 109.529 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 22' ' ' GLY . 0.2 OUTLIER -114.74 97.54 6.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.9 . . . . 0.0 109.513 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 49.78 -179.85 0.02 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' B' ' 22' ' ' GLY . 81.0 m-20 52.06 174.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -1.162 . . . . 0.0 109.452 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -172.44 59.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.24 -0.912 . . . . 0.0 109.511 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.523 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -169.2 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.275 -0.891 . . . . 0.0 109.542 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.488 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 1.4 mptt -122.97 160.75 25.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 109.54 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.763 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.8 mp -109.27 132.29 54.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.928 . . . . 0.0 109.584 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -79.73 170.12 16.98 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -45.82 -25.01 0.45 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.879 -1.138 . . . . 0.0 109.324 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.509 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 0.2 OUTLIER -82.28 -50.54 8.84 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.646 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.763 ' C ' HD23 ' B' ' 27' ' ' LEU . 43.0 mt-10 -56.68 -38.65 72.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.13 . . . . 0.0 109.402 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.873 HD22 HD23 ' B' ' 60' ' ' LEU . 16.0 mt -65.02 -57.44 8.68 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.594 -0.691 . . . . 0.0 109.293 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 1.13 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -42.27 -50.29 4.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.339 -0.851 . . . . 0.0 109.497 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -51.58 -61.62 2.13 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.188 -0.945 . . . . 0.0 109.151 179.736 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 1.072 HD11 HG13 ' B' ' 13' ' ' VAL . 1.1 tp -43.47 -38.1 2.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.311 -0.868 . . . . 0.0 109.43 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 1.045 HG13 HG22 ' B' ' 53' ' ' VAL . 3.0 mm -57.18 -49.93 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.229 -0.919 . . . . 0.0 109.586 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' B' ' 39' ' ' GLU . 51.1 m-80 -93.01 -65.35 1.0 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 109.807 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' B' ' 37' ' ' ASN . 0.6 OUTLIER -41.14 -26.92 0.06 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.412 -0.805 . . . . 0.0 110.265 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 3.9 mm-40 -118.73 -40.54 2.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.987 -1.071 . . . . 0.0 109.986 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 5.3 mp -108.14 67.11 0.66 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.094 -1.004 . . . . 0.0 109.596 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 28.1 t . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 109.417 179.879 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.72 HD12 ' CG2' ' B' ' 53' ' ' VAL . 10.5 mm . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.1 mmtp -111.28 55.33 0.66 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.501 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 3.0 tp10 74.31 41.79 0.36 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.261 -0.9 . . . . 0.0 109.353 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.455 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 72.51 51.48 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.304 -0.872 . . . . 0.0 109.447 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 24.7 tt0 -88.65 -70.16 0.66 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.492 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 1.4 t -87.47 -21.21 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.349 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.13 HG11 ' CD ' ' B' ' 33' ' ' LYS . 77.0 t -73.54 -26.06 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.207 -0.933 . . . . 0.0 109.27 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -85.16 -47.95 9.62 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 109.438 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 14.0 mttt -62.58 -41.9 99.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.213 -0.929 . . . . 0.0 109.395 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.917 ' HB ' HD13 ' B' ' 60' ' ' LEU . 31.1 m -59.28 -49.34 83.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 O-C-N 121.196 -0.94 . . . . 0.0 109.474 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -44.5 -26.38 0.35 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.977 -1.077 . . . . 0.0 109.453 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 55' ' ' LYS . 0.8 OUTLIER -77.08 -45.79 25.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.224 -0.922 . . . . 0.0 108.994 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.443 ' O ' ' C ' ' B' ' 60' ' ' LEU . 66.5 m -84.31 -63.81 1.27 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.312 -0.867 . . . . 0.0 109.371 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.917 HD13 ' HB ' ' B' ' 56' ' ' VAL . 9.1 mp -41.73 -27.86 0.12 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.585 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' B' ' 57' ' ' MET . 3.6 m-20 -63.55 114.68 4.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.256 -0.903 . . . . 0.0 109.333 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' B' ' 67' ' ' GLU . 16.5 t30 -42.77 -44.31 4.34 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.386 -0.821 . . . . 0.0 109.623 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.73 28.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.245 -0.909 . . . . 0.0 109.566 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.3 90.87 1.18 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' B' ' 65' ' ' ASP . 43.5 t0 -179.34 -34.44 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.11 . . . . 0.0 108.581 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.479 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.12 38.65 1.64 Allowed Glycine 0 N--CA 1.485 1.912 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' B' ' 62' ' ' ASN . 15.2 pt-20 -141.09 105.74 4.9 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.205 -1.174 . . . . 0.0 109.469 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.488 ' N ' ' HB3' ' B' ' 26' ' ' LYS . 12.2 t -78.59 153.4 31.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.256 -0.902 . . . . 0.0 109.748 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.495 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -110.13 171.16 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.643 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -61.27 -48.95 79.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.155 -0.965 . . . . 0.0 109.973 -179.804 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.582 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 9.4 mp0 -54.84 -40.19 69.35 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 108.953 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.2 mt-10 -78.83 -18.47 53.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.407 -0.808 . . . . 0.0 109.527 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.763 ' CZ ' HD23 ' B' ' 10' ' ' LEU . 3.5 t80 -67.25 -62.14 1.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.181 -0.949 . . . . 0.0 109.046 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.959 ' HB3' ' HB2' ' A' ' 78' ' ' ALA . 1.8 tpp -63.51 -48.04 79.23 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.108 -0.995 . . . . 0.0 108.978 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.684 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -51.54 -36.47 45.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.161 -0.962 . . . . 0.0 108.622 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.757 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.2 OUTLIER -57.86 -62.95 1.44 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.235 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.605 HG21 HD21 ' B' ' 10' ' ' LEU . 3.5 t -49.74 -27.9 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.921 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -58.4 -54.56 45.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.387 -0.821 . . . . 0.0 109.093 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 54.7 mtm -71.47 -68.84 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.365 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.757 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -40.6 -26.48 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 120.602 -1.311 . . . . 0.0 110.036 -179.637 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.517 ' N ' ' O ' ' B' ' 79' ' ' MET . 3.7 m -75.11 -70.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.993 -1.067 . . . . 0.0 108.7 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.7 t -78.08 -49.63 13.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.124 -0.985 . . . . 0.0 108.455 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.78 -44.22 0.72 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.752 -0.592 . . . . 0.0 109.71 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.408 ' O ' ' HB3' ' B' ' 87' ' ' PHE . 0.5 OUTLIER -89.37 -28.86 19.5 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.571 -179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' B' ' 81' ' ' THR . 0.8 OUTLIER -65.54 -70.06 0.26 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' B' ' 85' ' ' HIS . 0.0 OUTLIER -43.95 -28.32 0.45 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.505 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 87' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' B' ' 84' ' ' CYS . 11.2 t80 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.202 -0.936 . . . . 0.0 109.417 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.544 ' HB2' ' CB ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.805 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.5 OUTLIER -68.28 -79.45 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.821 HD11 HG11 ' B' ' 13' ' ' VAL . 4.9 mp -68.13 -23.04 64.85 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.164 -0.96 . . . . 0.0 109.421 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.544 ' CB ' ' HB2' ' A' ' 1' ' ' SER . 0.2 OUTLIER -63.3 -60.84 2.86 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.23 -0.918 . . . . 0.0 109.229 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 1' ' ' SER . 4.1 tttt -60.73 -29.58 69.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.342 -0.848 . . . . 0.0 109.182 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -71.42 -26.72 62.87 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.34 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.474 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.9 ttm -75.62 -38.71 58.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.332 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.84 -39.49 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.313 -0.867 . . . . 0.0 109.433 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.815 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -72.85 -62.93 1.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 109.508 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.675 ' CD2' HD23 ' B' ' 3' ' ' LEU . 48.7 mt -44.12 -43.69 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.385 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.474 HD12 ' O ' ' A' ' 7' ' ' MET . 62.3 mt -56.75 -53.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.5 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -54.51 -22.78 13.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.942 ' CG1' HD11 ' A' ' 35' ' ' LEU . 4.2 t -82.58 -33.7 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.29 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.547 ' CZ ' ' N ' ' A' ' 70' ' ' PHE . 9.9 t80 -63.12 -47.46 82.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.055 -1.028 . . . . 0.0 109.523 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -80.72 -46.33 15.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 109.712 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -54.52 -62.45 1.65 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 109.669 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.599 ' CD1' HG13 ' A' ' 13' ' ' VAL . 30.2 m-85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.657 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 26.2 m -60.16 -21.43 61.65 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.158 -0.964 . . . . 0.0 109.617 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.66 30.28 10.75 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' CG ' ' HA ' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.01 -50.78 5.82 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -1.17 . . . . 0.0 109.511 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . 81.3 mt-10 -134.72 83.99 2.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.258 -0.901 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.82 -170.81 54.94 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.422 ' O ' ' HD2' ' A' ' 24' ' ' LYS . 88.7 m-20 47.75 -169.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.313 -1.11 . . . . 0.0 109.502 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' C ' ' HB3' ' A' ' 18' ' ' SER . 0.3 OUTLIER -169.31 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.491 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -108.08 16.15 23.61 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.251 -0.906 . . . . 0.0 109.44 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -151.14 170.14 20.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.209 -0.932 . . . . 0.0 109.452 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.8 HD23 ' C ' ' A' ' 31' ' ' GLU . 3.0 mp -108.46 141.22 40.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.88 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.607 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.8 OUTLIER -91.15 79.19 5.77 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 109.079 179.532 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.586 ' CG ' ' CG ' ' A' ' 57' ' ' MET . 0.0 OUTLIER 41.53 -83.03 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.578 -0.701 . . . . 0.0 111.17 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.607 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -49.24 -27.43 3.73 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.669 -1.269 . . . . 0.0 109.711 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.8 ' C ' HD23 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -60.31 -46.19 90.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.916 -1.115 . . . . 0.0 108.617 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.706 ' N ' HD23 ' A' ' 27' ' ' LEU . 7.0 mt -59.75 -51.76 68.39 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 1.007 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -46.36 -36.53 6.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 109.338 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -53.49 43.89 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.592 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.942 HD11 ' CG1' ' A' ' 13' ' ' VAL . 4.7 mt -50.72 -52.52 39.63 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.713 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.027 HG23 HD12 ' A' ' 40' ' ' LEU . 1.9 mp -66.51 -24.59 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.262 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -90.98 -3.72 57.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.222 -0.924 . . . . 0.0 109.615 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -114.05 -14.42 12.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.239 -0.913 . . . . 0.0 109.496 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.742 ' OE1' HD22 ' B' ' 3' ' ' LEU . 5.9 pt-20 -120.94 -14.93 8.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.483 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.027 HD12 HG23 ' A' ' 36' ' ' ILE . 23.8 mt -120.2 75.12 1.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.477 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.911 ' CD1' HG21 ' A' ' 36' ' ' ILE . 43.4 mt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 7.4 pttm 40.24 28.48 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.636 -0.665 . . . . 0.0 109.877 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.492 ' H ' HG22 ' A' ' 47' ' ' ILE . 5.8 tt0 170.56 -78.83 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -0.873 . . . . 0.0 109.3 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 14.1 pt20 -168.04 26.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.874 . . . . 0.0 109.518 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.25 -69.28 0.3 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.234 -0.916 . . . . 0.0 109.413 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.769 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.6 t -86.67 -21.13 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 109.342 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.007 HG11 ' HG3' ' A' ' 33' ' ' LYS . 41.3 t -77.02 -19.29 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.286 -0.884 . . . . 0.0 109.762 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 53.9 t0 -90.06 -36.5 14.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.181 -0.949 . . . . 0.0 109.598 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -79.74 -38.01 34.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 52' ' ' VAL . 30.8 m -60.43 -43.74 94.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.193 -0.942 . . . . 0.0 109.773 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.586 ' CG ' ' CG ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -39.78 -29.08 0.05 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.078 -1.014 . . . . 0.0 109.488 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.495 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -87.04 -42.56 12.99 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.811 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.908 HG21 ' CE ' ' A' ' 79' ' ' MET . 98.9 m -70.03 -64.92 0.8 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.79 . . . . 0.0 109.587 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.64 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 7.3 mt -38.4 -60.43 0.79 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.474 -0.766 . . . . 0.0 109.589 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.41 112.26 6.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.271 -0.893 . . . . 0.0 109.534 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -120.02 16.67 12.5 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.415 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.24 -47.87 2.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 92.17 2.18 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.89 -35.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -1.126 . . . . 0.0 108.567 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.12 22.83 6.66 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HB2' ' HE2' ' A' ' 26' ' ' LYS . 19.5 pt-20 -128.44 118.54 23.28 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -1.119 . . . . 0.0 109.437 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.82 132.51 46.17 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.25 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 1.2 p30 -104.59 169.62 8.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.301 -0.874 . . . . 0.0 108.97 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.547 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.19 -47.99 54.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.059 -1.026 . . . . 0.0 110.105 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 75' ' ' ALA . 14.1 pt20 -52.48 -37.5 57.35 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.672 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.524 ' OE2' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -82.38 -20.5 37.04 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.065 -1.022 . . . . 0.0 109.775 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 1.6 t80 -66.66 -64.27 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.133 -0.979 . . . . 0.0 109.061 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.867 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.9 -32.82 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.384 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.663 ' HA ' ' HB2' ' B' ' 75' ' ' ALA . . . -65.33 -31.71 72.98 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.263 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.736 ' CZ ' HG21 ' A' ' 56' ' ' VAL . 1.1 t80 -70.44 -59.22 2.98 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.293 -0.879 . . . . 0.0 108.976 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.447 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.4 t -56.57 -25.39 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.989 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.67 -49.2 71.9 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.383 -0.823 . . . . 0.0 109.369 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.908 ' CE ' HG21 ' A' ' 59' ' ' THR . 2.3 mtm -71.94 -70.76 0.31 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.333 -0.855 . . . . 0.0 109.682 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.8 HG11 HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -41.91 -25.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 O-C-N 120.623 -1.298 . . . . 0.0 110.242 -179.187 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.606 HG21 ' HE1' ' B' ' 74' ' ' MET . 3.8 m -74.91 -68.03 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.875 -1.141 . . . . 0.0 108.589 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.8 m -81.68 -51.48 8.15 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.07 -40.64 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.206 0.527 . . . . 0.0 109.913 179.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.02 -40.89 30.22 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.605 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.2 OUTLIER -64.98 -11.89 43.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.139 -0.975 . . . . 0.0 109.477 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.451 ' OE2' HG23 ' A' ' 82' ' ' THR . 0.5 OUTLIER -90.31 -36.0 14.93 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.42 ' C ' ' O ' ' A' ' 86' ' ' GLU . 2.9 m-85 . . . . . 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 0.0 109.535 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.815 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 6.4 mm-40 -71.22 -63.47 1.1 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.248 -0.907 . . . . 0.0 109.386 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.76 HD11 ' CD2' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.18 -25.32 63.38 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.43 -65.6 0.67 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.317 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.426 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.1 OUTLIER -62.97 -37.06 85.58 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.273 -0.892 . . . . 0.0 109.25 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -68.71 -17.23 64.03 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.411 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.25 -39.86 20.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.503 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.456 ' O ' HG22 ' B' ' 11' ' ' ILE . 2.4 p -68.97 -31.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.17 -0.956 . . . . 0.0 109.449 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -83.3 -50.42 8.4 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.562 HD12 ' O ' ' B' ' 6' ' ' ALA . 5.4 mt -57.75 -34.71 69.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.794 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -73.26 -47.61 46.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.15 -0.969 . . . . 0.0 109.402 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.576 ' N ' HG23 ' B' ' 11' ' ' ILE . 65.8 t0 -57.34 -19.96 25.83 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.124 -0.985 . . . . 0.0 108.894 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.869 HG22 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -88.14 -41.94 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.37 -0.831 . . . . 0.0 109.632 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.473 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 34.2 t80 -53.93 -42.89 69.3 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.887 -1.133 . . . . 0.0 109.041 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.417 ' O ' ' C ' ' B' ' 16' ' ' GLN . 8.3 t-160 -77.58 -38.65 47.88 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.346 -0.846 . . . . 0.0 109.281 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' B' ' 15' ' ' HIS . 0.9 OUTLIER -44.03 -48.61 8.83 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 108.958 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.869 ' CE2' HG22 ' B' ' 13' ' ' VAL . 12.7 m-85 -92.47 -70.27 0.7 Allowed 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.403 -0.811 . . . . 0.0 109.107 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 4.1 p 38.87 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.594 -0.691 . . . . 0.0 109.99 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 88.12 44.19 5.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.428 ' C ' ' O ' ' B' ' 19' ' ' GLY . 0.1 OUTLIER -42.49 -27.42 0.16 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -1.042 . . . . 0.0 109.625 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.434 ' O ' ' HE2' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -100.05 69.91 1.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.03 -115.51 2.34 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' B' ' 19' ' ' GLY . 70.6 m-20 -61.85 148.61 42.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -1.17 . . . . 0.0 109.551 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.9 tttt -119.29 34.6 5.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.258 -0.901 . . . . 0.0 109.512 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.536 ' HB2' ' CE ' ' B' ' 26' ' ' LYS . 23.7 m-70 -136.98 8.84 3.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.536 ' CE ' ' HB2' ' B' ' 25' ' ' HIS . 0.3 OUTLIER -169.95 156.24 6.03 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.713 ' CD1' HD12 ' B' ' 35' ' ' LEU . 9.8 mt -85.08 147.5 26.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -125.63 85.75 2.44 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.839 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.633 ' HA ' HD12 ' B' ' 32' ' ' LEU . 12.6 tppt? 60.97 -86.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.361 -0.837 . . . . 0.0 110.211 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.508 ' N ' ' HG3' ' B' ' 29' ' ' LYS . 7.2 m -44.04 -52.49 7.07 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.172 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' B' ' 27' ' ' LEU . 0.3 OUTLIER -55.91 -38.42 70.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.12 -0.987 . . . . 0.0 109.469 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 29' ' ' LYS . 36.7 mt -61.25 -70.17 0.2 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.579 -0.701 . . . . 0.0 109.291 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.1 OUTLIER -44.85 -24.61 0.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.687 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.446 ' OE1' ' O ' ' B' ' 30' ' ' SER . 0.1 OUTLIER -71.52 -69.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.134 -0.979 . . . . 0.0 109.537 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.811 HD21 ' CG1' ' B' ' 13' ' ' VAL . 2.4 mt -43.99 -47.91 8.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.305 -0.872 . . . . 0.0 109.732 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.767 ' CG2' HG11 ' B' ' 80' ' ' VAL . 11.6 mm -60.93 -43.07 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.656 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.459 ' HA ' ' HB3' ' B' ' 41' ' ' SER . 13.5 m-80 -90.18 8.38 33.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' B' ' 34' ' ' GLU . 2.1 t30 -94.0 -46.25 7.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.199 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.541 ' OE1' HD13 ' A' ' 3' ' ' LEU . 3.8 mp0 -124.64 -9.9 7.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.896 . . . . 0.0 109.601 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.732 HD11 HG13 ' B' ' 77' ' ' VAL . 5.2 mp -112.93 37.38 3.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.203 -0.935 . . . . 0.0 109.496 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' B' ' 37' ' ' ASN . 2.9 p . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.185 -0.947 . . . . 0.0 109.489 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.962 HD11 ' CG1' ' B' ' 80' ' ' VAL . 43.7 mt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.512 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.0 mtmt 43.54 27.02 0.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.251 -0.906 . . . . 0.0 109.516 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 170.85 -75.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.409 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' HB ' ' B' ' 53' ' ' VAL . 0.5 OUTLIER -169.62 27.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.218 -0.926 . . . . 0.0 109.553 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.79 -70.24 0.27 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.217 -0.927 . . . . 0.0 109.303 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.979 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.0 t -87.76 -14.72 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.195 -0.941 . . . . 0.0 109.258 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.759 HG23 HD13 ' B' ' 47' ' ' ILE . 43.1 t -77.73 -19.16 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.116 -0.99 . . . . 0.0 109.249 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -90.09 -37.18 14.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.227 -0.921 . . . . 0.0 109.284 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -47.5 20.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.309 -0.869 . . . . 0.0 109.352 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.925 HG11 HG22 ' B' ' 80' ' ' VAL . 31.1 m -55.3 -46.2 78.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.229 -0.919 . . . . 0.0 109.63 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.16 -47.47 6.23 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.204 -0.935 . . . . 0.0 109.887 -179.675 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.17 -56.42 21.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 109.824 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.998 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.7 t -67.64 -9.43 43.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.201 -0.937 . . . . 0.0 109.803 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.83 HD21 ' CD2' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -97.95 -11.47 23.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 0.0 109.52 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.438 ' OD2' ' SD ' ' B' ' 57' ' ' MET . 48.9 m-20 -83.47 114.78 21.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.355 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -101.24 -17.31 16.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.935 . . . . 0.0 109.67 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -141.06 8.97 2.1 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.157 -0.965 . . . . 0.0 109.741 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 71.79 94.48 0.08 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 1.0 OUTLIER 169.22 -28.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.333 -1.098 . . . . 0.0 108.45 -179.831 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.48 -5.69 29.84 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.512 ' HB3' ' CD ' ' B' ' 26' ' ' LYS . 1.8 mm-40 -69.91 110.34 4.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -1.147 . . . . 0.0 109.219 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 14.3 t -87.89 156.49 19.34 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.179 -0.951 . . . . 0.0 109.675 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.452 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.6 OUTLIER -116.33 170.9 8.19 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.733 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.584 ' CZ ' HG12 ' B' ' 11' ' ' ILE . 1.2 t80 -57.73 -51.58 68.97 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.197 -0.94 . . . . 0.0 110.167 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.75 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.0 pt20 -53.81 -44.05 69.87 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.466 -0.771 . . . . 0.0 109.3 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' B' ' 76' ' ' PHE . 3.3 mt-10 -74.05 -19.37 60.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.328 -0.857 . . . . 0.0 109.617 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.537 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 12.6 t80 -65.7 -63.1 1.17 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.244 -0.91 . . . . 0.0 109.178 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.989 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 0.5 OUTLIER -58.65 -46.07 87.93 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.196 -0.94 . . . . 0.0 108.743 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' HA ' ' A' ' 75' ' ' ALA . . . -58.44 -26.53 63.43 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.221 -0.924 . . . . 0.0 108.525 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.83 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.0 OUTLIER -64.17 -69.26 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.511 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.732 HG13 HD11 ' B' ' 40' ' ' LEU . 39.3 t -51.68 -23.65 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.437 -0.789 . . . . 0.0 109.122 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.867 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -63.95 -45.58 88.51 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.289 -0.882 . . . . 0.0 109.304 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.998 ' SD ' HG21 ' B' ' 59' ' ' THR . 42.7 mtm -78.03 -64.35 1.18 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.89 . . . . 0.0 109.677 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.979 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.89 -23.04 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 O-C-N 120.481 -1.387 . . . . 0.0 109.526 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.603 ' OG1' HD21 ' B' ' 40' ' ' LEU . 4.8 m -78.85 -67.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.04 -1.037 . . . . 0.0 109.113 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.2 t -77.1 -49.3 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.0 109.037 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.92 -39.86 0.25 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.747 -0.595 . . . . 0.0 109.966 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 29.6 t -67.55 -49.38 63.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.242 -0.911 . . . . 0.0 109.554 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -9.93 51.73 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.564 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 87' ' ' PHE . 1.6 tm-20 -89.9 -23.65 21.56 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.229 -0.919 . . . . 0.0 109.525 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' B' ' 86' ' ' GLU . 3.4 t80 . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 1.2 m . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.615 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -62.1 -39.2 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.257 -0.902 . . . . 0.0 109.612 -179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.782 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.2 mm? -80.56 -28.52 37.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.24 -0.912 . . . . 0.0 109.551 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 8.8 tp10 -64.9 -58.64 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mmtt -65.79 -37.75 87.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.253 -0.904 . . . . 0.0 109.581 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -67.59 -18.45 64.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.617 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.527 ' HG2' HD12 ' A' ' 11' ' ' ILE . 14.4 ttp -82.6 -49.68 9.59 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.928 . . . . 0.0 109.561 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.95 -27.71 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' B' ' 2' ' ' GLU . . . -78.29 -65.63 0.95 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.576 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.66 HD13 ' HG3' ' A' ' 74' ' ' MET . 19.9 mt -49.76 -46.13 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.585 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.527 HD12 ' HG2' ' A' ' 7' ' ' MET . 50.8 mt -58.88 -44.86 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.523 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 26.4 t0 -62.59 -21.42 65.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.935 HG11 HD21 ' B' ' 3' ' ' LEU . 2.8 t -85.25 -26.0 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.2 -0.938 . . . . 0.0 109.425 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 2.9 t80 -72.43 -52.08 17.49 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.974 -1.078 . . . . 0.0 109.285 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.545 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 0.3 OUTLIER -74.48 -30.31 61.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.885 . . . . 0.0 109.635 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 25.3 tt0 -72.4 -63.32 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 0.0 109.603 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.527 ' HA ' ' CD ' ' A' ' 20' ' ' ARG . 11.2 m-85 -56.44 -28.86 60.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.251 -0.905 . . . . 0.0 109.411 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.545 ' HG ' ' HA ' ' A' ' 15' ' ' HIS . 60.8 p -77.59 -31.0 52.73 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.498 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.51 -22.56 63.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 17.3 mtp85 -69.04 -27.6 65.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -1.144 . . . . 0.0 109.453 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.521 ' CG ' ' N ' ' A' ' 22' ' ' GLY . 46.8 tt0 -97.91 165.74 11.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.252 -0.905 . . . . 0.0 109.393 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.521 ' N ' ' CG ' ' A' ' 21' ' ' GLU . . . -43.93 -63.01 2.42 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.01 -177.68 0.28 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.284 -1.127 . . . . 0.0 109.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 15' ' ' HIS . 28.8 mtmt -143.69 45.56 1.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.253 -0.905 . . . . 0.0 109.469 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.437 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t60 -164.91 25.7 0.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 109.455 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.745 ' C ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -170.03 170.21 7.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.264 -0.898 . . . . 0.0 109.486 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 26' ' ' LYS . 9.7 mp -120.49 164.69 16.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.487 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -122.59 69.65 0.98 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.235 -0.916 . . . . 0.0 109.504 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.668 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER 63.05 -83.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.618 -0.676 . . . . 0.0 110.686 179.441 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -46.68 -35.4 5.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.146 -0.971 . . . . 0.0 110.86 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.597 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.7 mp0 -62.64 -42.3 99.52 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 108.851 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.703 HD22 ' CD2' ' A' ' 60' ' ' LEU . 5.1 mt -57.6 -56.62 19.6 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.633 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.5 -45.35 4.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.426 -0.796 . . . . 0.0 109.431 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.422 ' HG2' ' NH2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -63.86 -42.39 97.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.346 -0.846 . . . . 0.0 109.616 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.596 HD21 HG13 ' A' ' 13' ' ' VAL . 18.6 mt -48.18 -60.25 2.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.26 -0.9 . . . . 0.0 109.799 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.822 HD13 ' CE2' ' A' ' 76' ' ' PHE . 1.8 mp -75.55 -16.9 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.308 -0.87 . . . . 0.0 109.729 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.455 HD22 HG12 ' A' ' 47' ' ' ILE . 3.5 m120 -93.62 1.09 56.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.188 -0.945 . . . . 0.0 109.709 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 34' ' ' GLU . 14.7 t30 -117.1 -25.39 7.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.138 -0.977 . . . . 0.0 109.295 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.597 ' HB2' HD12 ' B' ' 3' ' ' LEU . 68.8 mm-40 -126.58 -10.14 6.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.901 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.793 HD13 HG13 ' A' ' 36' ' ' ILE . 0.3 OUTLIER -120.08 56.61 0.96 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.042 -1.036 . . . . 0.0 109.489 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.7 p . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.301 -0.874 . . . . 0.0 109.385 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.73 HG13 HG21 ' A' ' 53' ' ' VAL . 8.2 mm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.6 mttt -86.27 61.82 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.252 -0.905 . . . . 0.0 109.251 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.5 OUTLIER 83.29 -42.49 0.1 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 109.647 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.49 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 2.1 mt-30 167.43 57.95 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.093 -1.004 . . . . 0.0 109.341 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 2.0 tt0 -89.29 -70.34 0.66 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.157 -0.964 . . . . 0.0 109.587 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.788 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.1 t -90.54 -20.74 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.113 -0.992 . . . . 0.0 109.238 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.73 HG21 HG13 ' A' ' 47' ' ' ILE . 24.9 t -77.22 -29.11 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.156 -0.965 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 0.5 OUTLIER -90.12 -32.41 16.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.38 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 1.1 tmtp? -75.88 -37.76 58.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.407 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 1.013 ' HB ' HD13 ' A' ' 60' ' ' LEU . 8.8 m -56.35 -53.2 42.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.211 -0.93 . . . . 0.0 109.748 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.592 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -40.16 -28.91 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.155 -0.966 . . . . 0.0 109.53 -179.713 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -75.03 -50.54 16.18 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.468 HG21 ' SD ' ' A' ' 79' ' ' MET . 14.3 m -79.19 -64.8 1.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 108.794 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.108 HD21 ' CG ' ' A' ' 76' ' ' PHE . 4.2 mp -38.09 -47.82 1.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.708 -0.62 . . . . 0.0 109.756 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 57' ' ' MET . 0.5 OUTLIER -88.3 86.9 7.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.54 -7.64 7.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.513 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -78.27 -41.7 33.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.488 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.46 2.12 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -177.28 -35.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.244 -1.151 . . . . 0.0 108.593 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.35 -13.38 36.51 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.485 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 8.5 mt-10 -108.67 147.38 31.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -1.13 . . . . 0.0 109.515 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.52 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 1.9 t -69.79 147.74 50.04 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.307 -0.87 . . . . 0.0 109.601 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -116.63 170.98 8.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.513 -0.742 . . . . 0.0 109.359 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -61.45 -52.05 66.16 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.346 -0.847 . . . . 0.0 110.453 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -51.94 -39.32 59.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.327 -0.858 . . . . 0.0 109.548 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.52 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 1.6 pt-20 -79.6 -22.58 43.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.157 -0.965 . . . . 0.0 109.637 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.411 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 10.8 t80 -62.28 -59.53 4.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 109.003 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.845 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 2.4 ttm -65.22 -44.8 87.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.314 -0.867 . . . . 0.0 109.1 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.24 -22.17 62.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.009 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 1.108 ' CG ' HD21 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.48 -63.59 1.09 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.815 . . . . 0.0 108.838 179.704 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.705 HG13 HD11 ' A' ' 40' ' ' LEU . 42.0 t -56.52 -23.1 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -63.48 -49.97 71.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.499 -0.751 . . . . 0.0 109.065 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.696 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 39.1 mtp -72.77 -70.11 0.37 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.388 -0.82 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -41.25 -25.84 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 120.575 -1.328 . . . . 0.0 110.02 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . 1.018 HG21 HD11 ' B' ' 11' ' ' ILE . 4.6 m -77.67 -69.96 0.51 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.936 -1.102 . . . . 0.0 108.629 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -77.8 -49.91 13.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.093 -1.004 . . . . 0.0 108.325 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.25 -48.21 1.77 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.371 0.605 . . . . 0.0 109.453 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 13.4 t -61.03 -46.3 91.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.317 -0.864 . . . . 0.0 109.403 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -68.43 -11.19 59.34 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.456 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' A' ' 87' ' ' PHE . 4.8 tp10 -86.99 -37.26 17.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.4 ' C ' ' O ' ' A' ' 86' ' ' GLU . 49.2 t80 . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.553 ' HB3' ' N ' ' B' ' 5' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.487 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 2.5 mp0 39.23 -93.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.577 -0.702 . . . . 0.0 110.249 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.935 HD21 HG11 ' A' ' 13' ' ' VAL . 20.5 mt -75.83 -50.41 15.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.932 . . . . 0.0 109.43 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' B' ' 1' ' ' SER . 0.9 OUTLIER -49.87 -34.54 20.43 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.176 -0.952 . . . . 0.0 109.023 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.553 ' N ' ' HB3' ' B' ' 1' ' ' SER . 0.5 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.256 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.493 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -66.15 -10.0 36.91 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 109.339 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.734 ' O ' HD12 ' B' ' 11' ' ' ILE . 4.0 mtp -80.5 -57.71 3.46 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.267 -0.895 . . . . 0.0 109.392 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 16.5 t -64.23 -32.71 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.3 -0.875 . . . . 0.0 109.351 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.615 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -70.19 -68.9 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.333 -0.854 . . . . 0.0 109.561 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 1.048 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -51.3 -60.39 3.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.255 -0.903 . . . . 0.0 109.493 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 81' ' ' THR . 28.2 mt -42.86 -41.06 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -59.12 -47.92 83.49 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.364 -0.835 . . . . 0.0 109.659 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.946 HG22 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -61.23 -34.05 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.137 -0.977 . . . . 0.0 109.673 -179.616 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.59 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 9.1 t80 -60.11 -70.32 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.045 -1.034 . . . . 0.0 109.159 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -64.79 -9.82 23.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.723 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.501 ' HB3' ' HA ' ' B' ' 13' ' ' VAL . 56.7 tp60 -75.49 -69.93 0.45 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.834 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 1.169 ' CE2' HD23 ' B' ' 35' ' ' LEU . 0.0 OUTLIER -100.26 21.37 13.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.145 -0.972 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.602 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.5 t -80.86 -19.9 43.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 109.328 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.508 ' CA ' ' HA ' ' B' ' 24' ' ' LYS . . . -103.1 8.71 53.94 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.471 ' HG2' ' CA ' ' B' ' 17' ' ' TYR . 22.1 mmt180 -52.89 -54.28 36.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -1.177 . . . . 0.0 109.449 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' CE ' ' B' ' 28' ' ' LYS . 1.0 OUTLIER -127.91 103.55 7.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.57 -147.48 16.42 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.47 ' O ' ' HA2' ' B' ' 19' ' ' GLY . 0.2 OUTLIER -71.41 167.28 19.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.249 -1.147 . . . . 0.0 109.474 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.508 ' HA ' ' CA ' ' B' ' 19' ' ' GLY . 3.5 mttp -104.93 40.85 1.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.924 . . . . 0.0 109.496 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -134.17 11.39 3.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.226 -0.921 . . . . 0.0 109.437 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.5 OUTLIER -161.71 169.99 20.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.458 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.804 HD13 ' OH ' ' B' ' 17' ' ' TYR . 59.1 mt -120.61 141.01 50.73 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.707 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.52 ' CE ' ' O ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -87.25 165.72 15.46 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.489 ' N ' ' HD3' ' B' ' 29' ' ' LYS . 6.8 mmtp -42.72 -31.86 0.52 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.267 -0.896 . . . . 0.0 109.011 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 30.6 p -73.5 -58.0 3.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.443 -0.786 . . . . 0.0 110.189 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.798 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.6 mp0 -45.61 -44.32 12.97 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.047 -1.033 . . . . 0.0 109.117 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' B' ' 27' ' ' LEU . 24.7 mt -54.09 -62.74 1.46 Allowed 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.636 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.2 OUTLIER -47.26 -23.17 0.5 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.893 . . . . 0.0 110.072 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 30' ' ' SER . 23.2 mm-40 -75.82 -70.28 0.44 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.976 -1.078 . . . . 0.0 109.99 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 1.169 HD23 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -42.98 -33.03 0.72 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.414 -0.804 . . . . 0.0 109.634 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.979 HD13 HG11 ' B' ' 80' ' ' VAL . 14.5 mt -72.5 -45.24 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.152 -0.967 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' B' ' 41' ' ' SER . 3.7 m120 -72.6 -9.36 58.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.539 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.56 -51.21 7.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.913 . . . . 0.0 109.369 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 3' ' ' LEU . 1.3 tt0 -102.67 -43.43 5.6 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.0 109.348 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' B' ' 36' ' ' ILE . 1.0 OUTLIER -86.63 58.75 5.24 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 109.484 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' B' ' 37' ' ' ASN . 6.8 p . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.439 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.861 HG13 HG21 ' B' ' 53' ' ' VAL . 1.8 mm . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.522 ' NZ ' ' HG3' ' B' ' 51' ' ' GLU . 9.8 pttt -43.26 -45.51 5.83 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.238 -0.914 . . . . 0.0 109.544 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.476 ' CG ' ' C ' ' B' ' 48' ' ' LYS . 7.1 mt-10 -154.83 -39.65 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.875 . . . . 0.0 109.301 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 167.72 58.97 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.319 -0.863 . . . . 0.0 109.383 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.522 ' HG3' ' NZ ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -86.45 -70.29 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.34 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.92 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -87.78 -27.11 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.929 . . . . 0.0 109.047 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.861 HG21 HG13 ' B' ' 47' ' ' ILE . 54.5 t -68.18 -20.42 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.306 -0.871 . . . . 0.0 109.042 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 4.8 t0 -90.16 -51.37 5.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.354 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -58.06 -33.88 69.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 52' ' ' VAL . 25.3 m -58.56 -50.82 77.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.168 -0.957 . . . . 0.0 109.519 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.603 ' HE1' HD11 ' B' ' 32' ' ' LEU . 0.8 OUTLIER -44.91 -26.25 0.39 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.923 -1.11 . . . . 0.0 109.373 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' B' ' 56' ' ' VAL . 9.8 mt-10 -74.9 -47.08 31.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.264 -0.897 . . . . 0.0 108.978 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.464 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 45.0 m -85.01 -63.47 1.32 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.274 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.949 HD21 ' CD1' ' B' ' 76' ' ' PHE . 10.7 mp -38.33 -32.99 0.08 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.608 -0.682 . . . . 0.0 109.902 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.456 ' OD2' ' O ' ' B' ' 57' ' ' MET . 76.0 m-20 -90.15 112.35 23.81 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.182 -0.949 . . . . 0.0 109.553 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.464 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -124.95 -29.3 3.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.225 -0.922 . . . . 0.0 109.641 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.401 ' OD1' ' HG3' ' B' ' 67' ' ' GLU . 1.4 p30 -82.17 -12.18 58.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.225 -0.922 . . . . 0.0 109.612 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 70.08 85.92 0.14 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 12.9 t0 178.14 -32.32 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.321 -1.105 . . . . 0.0 108.678 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.489 ' HA2' ' HE2' ' B' ' 29' ' ' LYS . . . 110.36 38.22 1.67 Allowed Glycine 0 N--CA 1.485 1.938 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -135.42 119.52 17.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.337 -1.096 . . . . 0.0 109.335 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.473 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 16.4 t -69.73 156.96 38.2 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 0.0 109.854 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.504 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -120.64 171.77 8.34 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.709 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -62.6 -50.94 69.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.353 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.414 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.8 pt20 -55.45 -40.18 71.25 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.139 -0.975 . . . . 0.0 108.944 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.8 OUTLIER -78.95 -17.9 54.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.314 -0.866 . . . . 0.0 109.184 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 1.048 ' CE2' HD23 ' B' ' 10' ' ' LEU . 5.3 t80 -65.41 -57.34 8.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.877 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -64.01 -42.13 97.24 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.011 -1.056 . . . . 0.0 108.408 179.136 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -67.64 -16.34 64.11 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.335 -0.853 . . . . 0.0 108.798 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.949 ' CD1' HD21 ' B' ' 60' ' ' LEU . 2.1 t80 -71.8 -62.63 1.35 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.466 ' HA ' HG23 ' B' ' 80' ' ' VAL . 75.2 t -62.0 -26.77 40.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.845 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -60.77 -44.72 96.4 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.39 -0.819 . . . . 0.0 109.099 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.677 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 12.8 mtp -73.67 -69.88 0.41 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.276 -0.89 . . . . 0.0 109.155 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.979 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -41.86 -26.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.7 -1.25 . . . . 0.0 109.615 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.502 ' N ' ' O ' ' B' ' 79' ' ' MET . 12.5 m -75.64 -70.09 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.043 -1.036 . . . . 0.0 108.868 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.569 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.9 t -78.07 -49.45 13.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.121 -0.987 . . . . 0.0 108.574 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.31 -41.53 0.63 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.257 0.551 . . . . 0.0 109.856 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.94 -36.45 27.98 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 109.649 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.8 t-160 -67.96 -9.95 49.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.165 -0.959 . . . . 0.0 109.658 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.514 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 1.4 pp20? -80.64 -13.43 59.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 109.61 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.168 -0.957 . . . . 0.0 109.545 -179.937 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.461 ' CB ' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.759 ' OE1' ' HB1' ' B' ' 9' ' ' ALA . 0.2 OUTLIER -63.9 -71.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.784 HD21 ' HZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -68.72 -24.54 64.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.538 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.461 ' HB2' ' CB ' ' A' ' 1' ' ' SER . 0.2 OUTLIER -59.67 -52.8 63.94 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.457 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -65.86 -48.89 70.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -60.81 -17.47 49.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.9 ttp -77.68 -61.43 1.99 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.197 -0.939 . . . . 0.0 109.54 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -49.69 -34.2 8.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.258 -0.902 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -66.4 0.56 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.506 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.47 ' HG ' HD22 ' B' ' 3' ' ' LEU . 0.3 OUTLIER -45.42 -25.73 0.46 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.905 HD13 ' HZ ' ' A' ' 70' ' ' PHE . 17.7 mm -68.93 -53.85 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.267 -0.896 . . . . 0.0 109.498 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.53 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 7.4 t0 -61.48 -18.73 60.35 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.31 -0.869 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.703 HG11 HD11 ' B' ' 3' ' ' LEU . 2.1 t -87.67 -28.84 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.254 -0.904 . . . . 0.0 109.374 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 5.1 t80 -70.05 -46.53 64.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.018 -1.051 . . . . 0.0 109.339 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.456 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 15.1 t-80 -80.5 -34.53 35.67 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.329 -0.857 . . . . 0.0 109.711 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 46.9 tt0 -65.17 -57.74 7.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.2 -0.938 . . . . 0.0 109.606 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.628 ' HE1' HG22 ' A' ' 13' ' ' VAL . 50.6 m-85 -65.45 -33.51 76.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.899 . . . . 0.0 109.569 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.535 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 59.9 p -82.23 0.96 38.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.216 -0.927 . . . . 0.0 109.698 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.94 -22.86 75.95 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 5.2 mtt-85 -77.03 -15.47 59.6 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.261 -1.141 . . . . 0.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -93.52 168.2 11.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 109.439 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -72.73 -38.1 57.07 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 1.8 m-20 -62.47 -34.92 77.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.126 . . . . 0.0 109.439 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 16.6 mtpt 74.97 0.82 3.64 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.579 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -138.11 7.42 2.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.0 109.573 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.535 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.0 OUTLIER -137.83 142.98 40.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.205 -0.934 . . . . 0.0 109.437 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.843 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.7 mp -86.85 161.15 18.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.171 -0.956 . . . . 0.0 109.51 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.52 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -126.59 73.73 1.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.291 -0.881 . . . . 0.0 109.279 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.636 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.6 tttm 63.71 -84.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.607 -0.683 . . . . 0.0 110.267 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 m -44.69 -48.24 10.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.168 -0.957 . . . . 0.0 110.535 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.843 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -56.62 -39.86 74.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.926 -1.109 . . . . 0.0 109.358 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.925 HD22 HD23 ' A' ' 60' ' ' LEU . 25.0 mt -60.88 -65.81 0.63 Allowed 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.542 -0.724 . . . . 0.0 109.208 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.575 ' HG3' HG11 ' A' ' 53' ' ' VAL . 3.7 ttpt -42.74 -27.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.346 -0.846 . . . . 0.0 109.527 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -67.22 -63.98 0.95 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.211 -0.931 . . . . 0.0 109.353 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.594 ' CD2' HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -44.32 -32.91 1.45 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.879 . . . . 0.0 109.528 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.681 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -70.13 -49.89 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.937 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HD11 ' A' ' 47' ' ' ILE . 2.7 m-20 -86.96 11.91 12.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 109.659 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.417 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 8.8 t-20 -109.46 -40.96 4.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.163 -0.961 . . . . 0.0 109.517 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.628 ' HG2' HD12 ' B' ' 3' ' ' LEU . 0.0 OUTLIER -121.61 -22.53 5.84 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.631 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.924 HD13 ' HB ' ' A' ' 80' ' ' VAL . 16.9 mt -97.18 33.4 1.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.144 -0.973 . . . . 0.0 109.438 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.457 179.904 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 1.008 HD13 HG21 ' A' ' 53' ' ' VAL . 33.0 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.2 mtmt 75.16 26.28 1.24 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.277 -0.89 . . . . 0.0 109.322 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 tt0 83.33 -43.38 0.1 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.693 -0.629 . . . . 0.0 109.802 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.418 ' CD ' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -178.15 54.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.075 -1.015 . . . . 0.0 109.499 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 48' ' ' LYS . 50.2 tp10 -90.03 -70.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.487 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.787 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.7 t -90.97 -16.12 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.173 -0.954 . . . . 0.0 109.316 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.008 HG21 HD13 ' A' ' 47' ' ' ILE . 41.2 t -80.76 -24.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.0 108.96 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.82 -33.07 21.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 109.119 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -41.97 26.83 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.35 -0.844 . . . . 0.0 109.293 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.958 ' HB ' HD13 ' A' ' 60' ' ' LEU . 28.6 m -58.81 -49.24 83.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 O-C-N 121.251 -0.906 . . . . 0.0 109.493 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.581 ' N ' HG23 ' A' ' 56' ' ' VAL . 4.3 tpt -42.97 -27.01 0.16 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.505 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 56' ' ' VAL . 2.0 tm-20 -79.04 -45.68 19.67 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.266 -0.897 . . . . 0.0 109.114 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 60' ' ' LEU . 22.3 m -79.03 -63.48 1.41 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 109.505 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.958 HD13 ' HB ' ' A' ' 56' ' ' VAL . 7.6 mp -37.92 -43.85 0.73 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.613 -0.679 . . . . 0.0 109.955 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.491 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 8.0 m-20 -90.11 69.99 7.29 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.159 -0.963 . . . . 0.0 109.453 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -95.69 -9.4 32.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' O ' ' A' ' 67' ' ' GLU . 2.7 p-10 -78.86 -13.45 59.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.182 -0.948 . . . . 0.0 109.503 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 65.26 83.86 0.09 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 13.5 t0 177.63 -32.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.206 -1.173 . . . . 0.0 108.658 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.24 36.57 1.94 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' OD1' ' A' ' 63' ' ' ASP . 39.5 mt-10 -148.94 124.18 10.19 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.299 -1.118 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.527 ' O ' ' CD ' ' A' ' 26' ' ' LYS . 14.0 t -69.9 155.23 40.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.199 -0.938 . . . . 0.0 109.659 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.491 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -115.47 171.27 7.82 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 179.679 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.905 ' HZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -60.77 -49.73 76.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 110.149 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' B' ' 79' ' ' MET . 50.4 mt-30 -54.72 -43.42 72.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 108.997 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.491 ' HG3' ' HB2' ' A' ' 69' ' ' ASP . 1.4 mt-10 -76.78 -16.95 59.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.392 -0.818 . . . . 0.0 109.649 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.615 ' CE2' HG12 ' A' ' 13' ' ' VAL . 13.7 t80 -71.08 -52.92 16.67 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.049 -1.032 . . . . 0.0 109.161 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.857 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.6 OUTLIER -65.14 -42.23 94.03 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.162 -0.961 . . . . 0.0 108.785 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -66.7 -25.17 66.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 108.734 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.833 ' CG ' HD21 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.21 -63.0 1.26 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.74 HG12 ' HE1' ' B' ' 7' ' ' MET . 96.9 t -62.59 -25.4 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.313 -0.867 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.85 -29.08 67.33 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.455 -0.778 . . . . 0.0 109.065 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.702 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 19.5 mtp -84.59 -70.88 0.55 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.31 -0.869 . . . . 0.0 109.188 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.924 ' HB ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -44.9 -25.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 O-C-N 120.416 -1.428 . . . . 0.0 109.458 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . 1.001 HG21 ' SD ' ' B' ' 7' ' ' MET . 41.7 m -81.75 -63.71 1.33 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 108.499 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.657 HG21 ' CB ' ' B' ' 70' ' ' PHE . 2.0 m -79.91 -54.6 5.66 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.702 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.51 -43.7 0.41 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.321 0.581 . . . . 0.0 109.753 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -71.14 -45.16 64.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.405 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 82' ' ' THR . 1.9 m-70 -62.43 -13.64 32.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.234 -0.916 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.88 -48.09 17.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.411 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.23 -0.919 . . . . 0.0 109.416 179.96 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.427 ' N ' ' HB3' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' B' ' 2' ' ' GLU . 1.1 tp10 -64.76 -76.46 0.07 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.249 -0.907 . . . . 0.0 109.444 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.703 HD11 HG11 ' A' ' 13' ' ' VAL . 12.1 mt -69.73 -21.4 63.46 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -0.936 . . . . 0.0 109.438 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.427 ' HB3' ' N ' ' B' ' 1' ' ' SER . 2.9 tt0 -63.92 -51.7 63.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 109.396 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -43.02 71.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.894 . . . . 0.0 109.4 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -71.7 -12.3 61.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' MET . . . . . 1.001 ' SD ' HG21 ' A' ' 81' ' ' THR . 16.7 tpp -83.71 -45.17 13.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 53.2 t -68.63 -34.15 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.759 ' HB1' ' OE1' ' A' ' 2' ' ' GLU . . . -72.07 -58.48 3.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.736 HD12 ' HB1' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -51.95 -55.24 21.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.262 -0.899 . . . . 0.0 109.476 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.699 HD11 ' CG2' ' A' ' 81' ' ' THR . 21.1 mt -47.85 -46.48 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.875 . . . . 0.0 109.5 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' B' ' 16' ' ' GLN . 5.0 t0 -56.63 -42.78 79.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.886 . . . . 0.0 109.549 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 3' ' ' LEU . 2.2 t -64.27 -25.51 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.243 -0.911 . . . . 0.0 109.572 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 31.1 t80 -72.05 -40.26 68.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.938 -1.101 . . . . 0.0 109.596 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.583 ' CE1' ' HG2' ' B' ' 24' ' ' LYS . 18.1 t60 -74.03 -38.2 64.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.915 . . . . 0.0 110.271 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -74.67 -59.62 2.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.68 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.593 ' CD1' HG13 ' B' ' 13' ' ' VAL . 15.6 m-85 -55.01 -31.89 61.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.323 -0.86 . . . . 0.0 109.496 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.563 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.5 p -86.6 -22.02 26.47 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.201 -0.937 . . . . 0.0 109.51 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -83.56 -13.59 75.55 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 37.6 mtp85 -64.17 -61.88 1.97 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -1.19 . . . . 0.0 109.46 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -133.77 124.98 27.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.66 -108.31 0.82 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -150.8 27.6 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -1.113 . . . . 0.0 109.479 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.583 ' HG2' ' CE1' ' B' ' 15' ' ' HIS . 0.0 OUTLIER 53.82 61.1 3.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 109.464 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.575 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 2.2 m170 -170.14 -35.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.585 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.579 ' CB ' ' CB ' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -129.19 170.35 13.67 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.56 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 31' ' ' GLU . 70.1 mt -119.09 136.97 53.88 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.218 -0.926 . . . . 0.0 110.022 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.46 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -86.6 165.96 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.514 ' CG ' ' SD ' ' B' ' 57' ' ' MET . 0.1 OUTLIER -42.84 -26.94 0.15 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.982 . . . . 0.0 109.87 -179.708 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -78.65 -49.38 13.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.208 -0.932 . . . . 0.0 110.411 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.836 ' HB3' HD22 ' B' ' 27' ' ' LEU . 37.1 mm-40 -55.98 -41.85 75.43 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.982 -1.074 . . . . 0.0 108.663 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.906 HD22 HD12 ' B' ' 60' ' ' LEU . 2.1 mt -57.61 -65.98 0.54 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.792 -0.568 . . . . 0.0 109.615 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.34 -30.96 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.367 -0.833 . . . . 0.0 109.648 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -67.91 0.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.923 . . . . 0.0 109.301 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.758 ' CD1' HD13 ' B' ' 27' ' ' LEU . 12.1 mt -45.72 -25.46 0.49 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 109.547 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.691 HD12 ' O ' ' B' ' 32' ' ' LEU . 0.7 OUTLIER -70.84 -59.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 108.91 179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -78.89 4.83 13.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 109.708 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -119.07 -11.11 9.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.399 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.879 ' OE1' HG13 ' B' ' 77' ' ' VAL . 5.4 tm-20 -101.94 -40.74 6.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 0.0 109.4 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.72 HD22 ' N ' ' B' ' 40' ' ' LEU . 2.7 mm? -88.22 -46.72 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.255 -0.903 . . . . 0.0 109.393 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.0 t . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.382 -0.824 . . . . 0.0 109.261 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.659 HD12 HG21 ' B' ' 36' ' ' ILE . 14.0 mm . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 6.2 mtmt 83.37 -60.12 0.13 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.639 -0.663 . . . . 0.0 109.973 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' HG2' ' B' ' 50' ' ' GLN . 5.4 pt-20 -143.88 -46.55 0.27 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.057 -1.027 . . . . 0.0 109.637 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -164.93 31.05 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.955 . . . . 0.0 109.721 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.15 -70.4 0.24 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -1.0 . . . . 0.0 109.082 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.991 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.1 t -84.11 -9.61 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.0 109.037 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HG3' ' B' ' 33' ' ' LYS . 2.2 t -82.5 -31.61 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.065 -1.022 . . . . 0.0 109.099 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 1.4 t70 -90.33 -29.57 18.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.411 -0.806 . . . . 0.0 109.191 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -84.39 -44.64 13.54 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.332 -0.855 . . . . 0.0 109.398 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 1.109 HG22 HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -68.2 -42.84 85.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 O-C-N 121.125 -0.984 . . . . 0.0 109.314 179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.514 ' SD ' ' CG ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -39.88 -55.0 2.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 110.318 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -58.44 -40.65 83.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.954 . . . . 0.0 109.323 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.678 HG21 ' SD ' ' B' ' 79' ' ' MET . 99.4 m -67.61 -20.2 65.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 110.356 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 1.109 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -82.2 -72.48 0.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.932 -1.105 . . . . 0.0 109.151 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.26 100.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 0.0 109.496 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.92 9.08 4.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.275 -0.891 . . . . 0.0 109.545 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.91 -29.78 9.27 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.936 . . . . 0.0 109.405 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.76 2.13 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -175.26 -36.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.257 -1.143 . . . . 0.0 108.521 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 -12.9 50.68 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.579 ' CB ' ' CB ' ' B' ' 26' ' ' LYS . 1.7 mm-40 -112.24 150.54 30.77 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.257 -1.143 . . . . 0.0 109.457 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.903 ' SG ' HD21 ' B' ' 32' ' ' LEU . 7.2 m -73.74 155.77 38.58 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.203 -0.936 . . . . 0.0 110.199 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.41 171.5 7.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.481 -0.762 . . . . 0.0 109.196 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.688 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -57.88 -53.63 56.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.238 -0.914 . . . . 0.0 110.672 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.495 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 1.9 pt20 -62.31 -29.99 70.83 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.23 -0.919 . . . . 0.0 108.687 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.486 ' HG2' ' HB3' ' B' ' 68' ' ' CYS . 1.1 tt0 -81.78 -15.25 54.86 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.784 ' HZ ' HD21 ' A' ' 3' ' ' LEU . 5.7 t80 -75.35 -52.3 11.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.185 -0.947 . . . . 0.0 108.938 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.819 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -66.64 -45.82 77.78 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.891 . . . . 0.0 109.188 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.09 -43.41 91.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 108.922 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.668 ' CE1' HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -49.15 -60.11 3.08 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.879 HG13 ' OE1' ' B' ' 39' ' ' GLU . 44.0 t -59.92 -25.57 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.342 -0.848 . . . . 0.0 108.714 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.857 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -60.86 -37.31 81.69 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.52 -0.737 . . . . 0.0 109.207 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.704 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 1.1 mtm -79.11 -66.79 0.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.991 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -47.95 -22.43 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 O-C-N 120.473 -1.392 . . . . 0.0 109.218 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 16.3 m -78.42 -66.44 0.85 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.059 -1.026 . . . . 0.0 108.915 178.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.8 t -81.37 -49.84 10.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.995 . . . . 0.0 108.756 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.85 -35.92 0.17 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.807 -0.558 . . . . 0.0 109.605 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 10.0 t -67.07 -52.89 36.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.367 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.49 -10.4 51.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.225 -0.922 . . . . 0.0 109.543 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -90.14 -34.56 15.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.193 -0.942 . . . . 0.0 109.493 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.901 . . . . 0.0 109.483 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.659 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.3 mp0 -73.96 -71.24 0.34 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.299 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.769 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.4 mp -61.48 -18.02 57.15 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.342 -0.849 . . . . 0.0 109.404 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.456 ' O ' ' CG ' ' A' ' 7' ' ' MET . 5.2 tt0 -68.89 -66.98 0.51 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.074 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.523 ' HA ' HG22 ' A' ' 8' ' ' VAL . 2.5 ttmt -65.49 -14.59 61.33 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.278 -0.889 . . . . 0.0 109.055 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.753 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -82.81 -29.4 29.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.332 -0.855 . . . . 0.0 109.117 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 8' ' ' VAL . 3.7 ptp -83.33 -23.77 32.39 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 109.251 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.554 HG23 ' N ' ' A' ' 9' ' ' ALA . 32.9 m -80.39 -44.33 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.261 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -71.23 -36.38 71.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.456 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.837 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -75.15 -54.18 7.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 109.626 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.837 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -46.62 -45.86 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.098 -1.001 . . . . 0.0 109.352 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.552 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -67.8 -34.17 76.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.192 -0.942 . . . . 0.0 109.583 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.03 HG11 HD21 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -73.97 -15.42 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.2 t80 -85.78 -41.88 14.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.01 -1.056 . . . . 0.0 109.281 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.459 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 10.6 m170 -74.47 -28.91 61.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.284 -0.885 . . . . 0.0 109.352 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -79.74 -60.29 2.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.911 . . . . 0.0 109.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.574 ' HB3' HD21 ' A' ' 27' ' ' LEU . 37.9 m-85 -59.0 -46.09 89.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.497 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 p -75.05 -11.94 60.21 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 109.481 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.545 ' HA3' ' CG ' ' A' ' 24' ' ' LYS . . . -94.99 26.62 18.0 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -90.06 -16.83 28.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -1.151 . . . . 0.0 109.569 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 23' ' ' ASP . 27.2 mt-10 -105.44 69.35 0.83 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.146 -0.971 . . . . 0.0 109.683 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.446 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . 39.58 28.43 0.12 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' N ' ' O ' ' A' ' 21' ' ' GLU . 11.9 t70 -179.47 137.26 0.13 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.098 -1.236 . . . . 0.0 109.662 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.545 ' CG ' ' HA3' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -108.83 112.94 25.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.304 -0.872 . . . . 0.0 109.383 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.459 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 3.0 t-80 -170.07 -35.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.642 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.54 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -145.06 170.2 16.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.814 HD23 ' C ' ' A' ' 31' ' ' GLU . 1.7 mp -117.79 128.0 54.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.236 -0.915 . . . . 0.0 110.032 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.547 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -74.26 161.39 29.97 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.005 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.547 ' N ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -28.93 0.24 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.873 -1.142 . . . . 0.0 109.488 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 28' ' ' LYS . 3.0 m -82.29 -40.73 21.11 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.376 -0.827 . . . . 0.0 110.164 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.814 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -58.64 -40.35 83.17 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.794 -1.191 . . . . 0.0 108.483 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.866 HD21 ' SG ' ' A' ' 68' ' ' CYS . 17.8 mt -62.94 -61.83 2.13 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.31 -27.22 0.14 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 109.757 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.28 -67.33 0.76 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.661 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.03 HD21 HG11 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -42.02 -30.73 0.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.424 -0.797 . . . . 0.0 110.086 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.052 HD12 HG21 ' A' ' 80' ' ' VAL . 6.0 mm -85.38 -41.86 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.187 -0.945 . . . . 0.0 109.421 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -87.51 11.6 14.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.482 ' HB3' ' OH ' ' A' ' 17' ' ' TYR . 3.8 m120 -118.09 -44.72 2.68 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.448 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 3' ' ' LEU . 13.8 mm-40 -109.32 -9.89 14.96 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.278 -0.889 . . . . 0.0 109.49 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.662 HD11 HG13 ' A' ' 77' ' ' VAL . 5.6 mp -119.63 41.78 3.05 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 109.471 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.495 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.649 HG23 HG23 ' A' ' 53' ' ' VAL . 8.6 mt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.517 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 6.4 ptmt 163.23 -34.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.286 -0.883 . . . . 0.0 109.384 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HG3' ' HG3' ' A' ' 50' ' ' GLN . 25.3 pt-20 -140.43 -38.44 0.44 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.87 . . . . 0.0 109.412 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.5 ' HG3' ' HG3' ' A' ' 49' ' ' GLU . 2.2 pt20 167.72 48.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.202 -0.936 . . . . 0.0 109.612 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.67 -70.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.178 -0.951 . . . . 0.0 109.281 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.956 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.3 t -91.63 -12.96 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.0 108.878 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.678 HG11 ' HD3' ' A' ' 33' ' ' LYS . 35.8 t -82.58 -27.51 8.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.14 -0.975 . . . . 0.0 108.84 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -90.46 -34.37 15.62 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.475 -0.766 . . . . 0.0 109.106 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -81.15 -45.15 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.342 -0.849 . . . . 0.0 109.407 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 1.067 HG22 HD21 ' A' ' 60' ' ' LEU . 1.3 p -64.9 -44.04 96.24 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.064 -1.023 . . . . 0.0 109.303 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -41.01 -47.58 3.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.584 -0.698 . . . . 0.0 109.922 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.06 -44.61 97.12 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.185 -0.947 . . . . 0.0 108.848 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 59' ' ' THR . 17.7 m -73.24 -8.95 58.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.444 -0.785 . . . . 0.0 109.608 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.067 HD21 HG22 ' A' ' 56' ' ' VAL . 2.9 mt -85.66 -74.69 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.145 -0.972 . . . . 0.0 109.388 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.71 93.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.61 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.26 13.32 34.7 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.261 -0.899 . . . . 0.0 109.412 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.02 -45.34 2.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.0 109.541 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.07 91.16 2.15 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.62 -36.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.301 -1.117 . . . . 0.0 108.492 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 39.81 2.12 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.54 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -156.38 113.39 3.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -1.157 . . . . 0.0 109.331 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' A' ' 32' ' ' LEU . 94.9 m -69.8 157.77 36.73 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.215 -0.928 . . . . 0.0 110.076 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -118.42 170.6 8.79 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.323 -0.861 . . . . 0.0 109.093 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.433 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.1 OUTLIER -50.56 -64.76 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.366 -0.834 . . . . 0.0 111.293 -179.216 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 5.4 pt20 -45.28 -27.95 0.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.039 -1.038 . . . . 0.0 108.732 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.615 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . 3.3 mt-10 -77.58 -41.8 37.51 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.501 -0.75 . . . . 0.0 110.009 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CE2' HD23 ' A' ' 10' ' ' LEU . 2.6 t80 -51.51 -50.41 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.81 -1.182 . . . . 0.0 109.016 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.851 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mtp -62.81 -38.7 91.75 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.5 -0.75 . . . . 0.0 109.347 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -69.6 -16.67 63.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.172 -0.955 . . . . 0.0 108.787 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.934 ' CD1' HD22 ' A' ' 60' ' ' LEU . 15.0 m-30 -75.14 -70.05 0.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.711 ' CG2' HD23 ' B' ' 3' ' ' LEU . 99.2 t -52.1 -29.97 12.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.056 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.906 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -62.93 -44.45 96.05 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.679 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.8 OUTLIER -76.3 -69.64 0.49 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 109.968 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 1.052 HG21 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.85 -23.38 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 O-C-N 120.575 -1.328 . . . . 0.0 109.717 -178.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.595 HG21 ' SD ' ' B' ' 7' ' ' MET . 15.7 m -80.4 -67.81 0.74 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.893 -1.129 . . . . 0.0 108.927 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.1 t -77.32 -49.72 14.37 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.95 . . . . 0.0 108.768 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.87 -30.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.408 0.623 . . . . 0.0 109.557 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.474 ' N ' ' O ' ' A' ' 82' ' ' THR . 42.9 t -89.66 -41.66 11.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.312 -0.868 . . . . 0.0 109.448 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.411 ' N ' ' O ' ' A' ' 82' ' ' THR . 36.1 t60 -63.19 -11.92 24.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.633 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' A' ' 86' ' ' GLU . 6.2 tp10 -82.06 -35.65 28.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.94 . . . . 0.0 109.442 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.3 -0.875 . . . . 0.0 109.492 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.459 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.808 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 5.2 mm-40 -64.82 -54.87 24.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.276 -0.89 . . . . 0.0 109.301 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.711 HD23 ' CG2' ' A' ' 77' ' ' VAL . 6.0 mp -70.98 -19.72 62.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.308 -0.87 . . . . 0.0 109.402 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.459 ' HB2' ' N ' ' B' ' 1' ' ' SER . 15.2 tp10 -63.05 -56.02 20.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.229 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.494 ' HD3' ' HD2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -64.69 -39.2 93.26 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.261 -0.899 . . . . 0.0 108.758 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -69.73 -16.12 63.27 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.299 -0.876 . . . . 0.0 109.106 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.946 ' CE ' HD13 ' B' ' 11' ' ' ILE . 6.5 tpt -77.23 -50.55 12.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.417 -0.802 . . . . 0.0 109.26 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.45 ' C ' HG22 ' B' ' 11' ' ' ILE . 12.2 p -65.29 -31.03 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.234 -0.916 . . . . 0.0 109.476 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.659 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -79.88 -69.76 0.56 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.932 . . . . 0.0 109.564 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.753 HD11 ' HB1' ' A' ' 6' ' ' ALA . 36.7 mt -43.91 -45.74 7.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 109.59 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.946 HD13 ' CE ' ' B' ' 7' ' ' MET . 0.5 OUTLIER -61.08 -46.66 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.204 -0.935 . . . . 0.0 109.449 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.584 ' N ' HG23 ' B' ' 11' ' ' ILE . 40.5 t0 -65.68 -15.2 62.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.276 -0.89 . . . . 0.0 109.475 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.653 HG21 ' HB2' ' A' ' 2' ' ' GLU . 2.2 t -89.7 -31.45 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 0.0 109.269 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.572 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 8.1 t80 -69.28 -46.13 67.95 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.995 -1.066 . . . . 0.0 109.123 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -78.14 -39.61 40.59 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.4 tt0 -62.92 -63.33 1.24 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 109.457 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.619 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 28.5 m-85 -53.7 -41.12 66.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.259 -0.9 . . . . 0.0 109.541 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB3' ' N ' ' B' ' 25' ' ' HIS . 1.7 m -61.51 -32.68 72.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.215 -0.928 . . . . 0.0 109.665 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.55 31.12 5.97 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.5 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 27.6 mmm180 -90.08 -30.84 17.44 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.15 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.6 mt-10 -153.71 93.99 1.73 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 109.525 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 57.99 158.16 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' C ' ' CG ' ' B' ' 24' ' ' LYS . 10.7 m-20 60.3 155.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.495 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.444 ' CG ' ' C ' ' B' ' 23' ' ' ASP . 0.9 OUTLIER -154.41 63.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.572 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -170.03 -35.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -118.98 167.27 11.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.0 109.588 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' B' ' 31' ' ' GLU . 79.6 mt -118.07 121.2 39.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.803 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.676 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.2 OUTLIER -73.08 168.13 19.7 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.179 -0.951 . . . . 0.0 108.655 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -43.34 -26.95 0.22 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.16 -0.962 . . . . 0.0 109.537 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.423 ' N ' ' O ' ' B' ' 28' ' ' LYS . 31.2 m -74.5 -62.41 1.53 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.288 -0.883 . . . . 0.0 109.975 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.936 ' HB3' HD22 ' B' ' 27' ' ' LEU . 48.2 mm-40 -45.72 -42.47 11.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.092 -1.005 . . . . 0.0 109.223 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 1.053 HD22 ' HE3' ' B' ' 57' ' ' MET . 4.3 mp -55.29 -69.44 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.601 -0.687 . . . . 0.0 109.264 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.999 ' HD3' HG11 ' B' ' 53' ' ' VAL . 4.5 mmtp -38.95 -32.47 0.09 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.465 -0.772 . . . . 0.0 109.744 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' B' ' 38' ' ' ASN . 0.3 OUTLIER -65.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.307 -0.87 . . . . 0.0 109.237 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 3' ' ' LEU . 3.9 mm? -44.43 -26.15 0.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.299 -0.875 . . . . 0.0 109.464 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.913 HG13 HG22 ' B' ' 53' ' ' VAL . 1.1 mm -75.01 -61.97 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -87.91 18.75 3.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.706 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 23.4 t-20 -114.54 -44.91 3.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -0.909 . . . . 0.0 109.261 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 18.3 mm-40 -123.46 -9.99 7.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.332 -0.855 . . . . 0.0 109.451 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' B' ' 36' ' ' ILE . 18.4 mt -109.06 52.86 0.7 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.442 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.569 179.983 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.932 ' CD1' HG21 ' B' ' 53' ' ' VAL . 42.8 mt . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.53 ' HB2' ' CG ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -86.26 61.37 6.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.224 -0.923 . . . . 0.0 109.393 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' B' ' 50' ' ' GLN . 0.5 OUTLIER 64.13 59.24 1.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.288 -0.883 . . . . 0.0 109.307 -179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 4.8 mt-30 65.33 48.93 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.324 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.53 ' CG ' ' HB2' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -88.8 -70.15 0.66 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.211 -0.931 . . . . 0.0 109.568 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 1.004 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -91.46 -12.88 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.449 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.999 HG11 ' HD3' ' B' ' 33' ' ' LYS . 75.3 t -84.34 -25.28 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.051 -1.031 . . . . 0.0 108.793 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -88.22 -33.93 17.95 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -51.28 8.23 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.429 -0.795 . . . . 0.0 108.956 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.898 ' O ' HD12 ' B' ' 60' ' ' LEU . 1.3 p -59.59 -40.61 82.54 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 O-C-N 121.208 -0.932 . . . . 0.0 108.92 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' MET . . . . . 1.053 ' HE3' HD22 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -42.17 -48.39 4.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.578 -0.701 . . . . 0.0 109.42 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.61 -43.2 99.41 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.291 -0.881 . . . . 0.0 109.071 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.417 ' O ' HG22 ' B' ' 59' ' ' THR . 8.3 m -66.27 -13.69 60.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.31 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 1.013 HD22 ' CD2' ' B' ' 32' ' ' LEU . 2.1 mp -95.29 -28.79 14.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 0.0 109.469 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.417 ' O ' ' C ' ' B' ' 62' ' ' ASN . 0.5 OUTLIER -65.46 114.32 4.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.214 -0.929 . . . . 0.0 109.535 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' B' ' 61' ' ' ASP . 2.5 t30 -44.31 -37.65 3.42 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 0.0 109.363 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 179.29 32.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.0 109.675 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 93.44 1.71 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.52 -35.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.339 -1.095 . . . . 0.0 108.446 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 101.36 38.61 3.23 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.504 ' CB ' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -143.5 104.39 4.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -1.134 . . . . 0.0 109.425 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.521 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.6 t -69.69 156.54 38.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.858 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.5 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -115.46 171.61 7.61 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.483 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -59.03 -50.84 72.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.156 -0.965 . . . . 0.0 110.357 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.491 ' HB3' ' CE ' ' A' ' 79' ' ' MET . 0.9 OUTLIER -56.24 -39.4 72.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.254 -0.904 . . . . 0.0 109.161 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.505 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -79.59 -16.07 56.52 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.463 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.538 ' CZ ' HG12 ' B' ' 13' ' ' VAL . 54.3 t80 -69.46 -56.3 7.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.224 -0.922 . . . . 0.0 108.705 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.906 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 10.7 mtt -63.74 -49.32 73.48 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.44 -26.36 65.13 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.304 -0.872 . . . . 0.0 108.963 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.663 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.1 OUTLIER -64.6 -70.59 0.22 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.408 -0.807 . . . . 0.0 108.862 179.681 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.577 HG21 ' CD2' ' A' ' 3' ' ' LEU . 87.9 t -56.42 -20.61 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.25 -0.906 . . . . 0.0 108.958 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -64.25 -54.38 34.22 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.46 -0.775 . . . . 0.0 109.423 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.633 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.4 OUTLIER -68.24 -61.36 1.88 Allowed 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.345 -0.847 . . . . 0.0 109.652 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 1.004 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -48.43 -22.08 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.361 -1.462 . . . . 0.0 109.376 -179.402 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 3.6 m -79.23 -69.94 0.54 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.039 -1.038 . . . . 0.0 109.185 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.8 t -73.82 -49.17 26.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.063 -1.023 . . . . 0.0 109.227 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.55 -43.84 0.42 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.756 -0.59 . . . . 0.0 109.893 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.53 -50.33 71.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.469 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -10.12 49.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.295 -0.878 . . . . 0.0 109.53 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 82' ' ' THR . 20.9 mt-10 -73.72 -19.02 60.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 109.539 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 24.3 t80 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.216 -0.928 . . . . 0.0 109.512 179.982 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.28 0.562 . . . . 0.0 109.487 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.705 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -64.05 -70.82 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.225 -0.922 . . . . 0.0 109.525 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.069 HD13 HD23 ' B' ' 10' ' ' LEU . 3.7 mm? -75.37 -32.5 60.85 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.468 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.0 OUTLIER -60.25 -60.29 4.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.272 -0.892 . . . . 0.0 109.559 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -63.07 -30.51 71.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -0.914 . . . . 0.0 109.507 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.725 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -75.4 -18.12 60.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.484 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.454 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 42.4 ttm -80.93 -48.88 11.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.459 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 42.5 t -68.29 -29.62 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 109.508 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -69.9 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.597 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.567 ' CD2' HD23 ' B' ' 3' ' ' LEU . 13.2 mt -46.0 -47.01 16.8 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 0.0 109.559 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.891 HD11 HG21 ' B' ' 81' ' ' THR . 12.3 mt -60.39 -41.16 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.933 . . . . 0.0 109.491 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.499 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 37.6 t0 -63.03 -21.4 66.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.493 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.027 HG21 HD11 ' B' ' 3' ' ' LEU . 2.3 t -84.11 -31.37 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.928 . . . . 0.0 109.391 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 15.1 t80 -68.0 -44.66 76.08 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.017 -1.052 . . . . 0.0 109.21 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -41.13 23.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.296 -0.877 . . . . 0.0 109.501 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.499 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 9.8 tt0 -60.16 -61.63 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.95 . . . . 0.0 109.443 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.656 ' CG ' HD21 ' A' ' 35' ' ' LEU . 32.7 m-85 -57.28 -50.66 72.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' ' HA ' ' A' ' 24' ' ' LYS . 38.1 t -61.24 -18.72 59.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.618 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -64.68 -31.8 82.1 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.428 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -70.3 -43.38 70.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.273 -1.134 . . . . 0.0 109.481 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 28' ' ' LYS . 22.2 tp10 -97.06 135.04 39.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.263 -0.898 . . . . 0.0 109.442 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 52.85 -145.78 19.46 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.458 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 0.4 OUTLIER -80.38 -74.65 0.3 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -1.137 . . . . 0.0 109.491 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.473 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 168.79 46.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 109.424 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.32 -14.72 7.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.0 109.695 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' CG ' ' HB3' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -149.04 170.08 19.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 0.0 109.613 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.904 HD22 ' HB3' ' A' ' 31' ' ' GLU . 96.4 mt -118.01 127.08 53.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.776 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 4.3 tttp -69.81 152.89 44.05 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' N ' ' A' ' 30' ' ' SER . 4.2 ptpt -37.14 -30.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.453 -0.779 . . . . 0.0 109.847 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.51 ' N ' ' HG3' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -74.97 -50.9 15.11 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.247 -0.908 . . . . 0.0 109.38 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.904 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.1 mp0 -49.91 -43.81 49.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 108.905 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.948 HD12 ' SD ' ' A' ' 57' ' ' MET . 31.3 mt -57.15 -66.82 0.39 Allowed 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.673 -0.642 . . . . 0.0 109.275 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.958 ' HG2' HG11 ' A' ' 53' ' ' VAL . 2.5 mttp -41.35 -31.35 0.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -0.835 . . . . 0.0 109.779 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -64.54 -68.61 0.34 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.18 -0.95 . . . . 0.0 109.35 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.656 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.1 mm? -44.04 -44.79 7.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.693 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -53.4 -48.09 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.202 -0.937 . . . . 0.0 109.631 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' C ' ' A' ' 38' ' ' ASN . 9.1 m-20 -73.97 -67.26 0.62 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.111 -0.993 . . . . 0.0 110.055 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.441 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.5 OUTLIER -40.83 -70.49 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.442 -0.786 . . . . 0.0 110.269 -179.436 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 77' ' ' VAL . 31.5 tt0 -67.59 -51.8 46.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.174 -0.954 . . . . 0.0 110.026 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.57 HD21 ' CA ' ' A' ' 81' ' ' THR . 2.4 mp -98.15 65.85 1.76 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.199 -0.938 . . . . 0.0 109.572 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.321 -0.862 . . . . 0.0 109.606 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.555 ' CD1' HG21 ' A' ' 53' ' ' VAL . 1.5 mt . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -43.03 -27.15 0.18 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.3 -0.875 . . . . 0.0 109.562 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.52 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 1.5 mm-40 164.23 63.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.398 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 2.9 mm-40 51.62 48.82 22.15 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.253 -0.905 . . . . 0.0 109.329 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -87.49 -70.07 0.65 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.588 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -88.16 -22.42 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.226 -0.921 . . . . 0.0 109.601 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.958 HG11 ' HG2' ' A' ' 33' ' ' LYS . 78.8 t -78.9 -29.93 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.068 -1.02 . . . . 0.0 109.262 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 19.5 t0 -77.12 -49.31 15.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.272 -0.892 . . . . 0.0 109.221 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -50.35 51.37 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.662 ' O ' HG22 ' A' ' 59' ' ' THR . 1.9 p -58.43 -49.35 82.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.09 -1.007 . . . . 0.0 109.072 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.948 ' SD ' HD12 ' A' ' 32' ' ' LEU . 8.5 tpt -41.53 -44.31 2.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.79 . . . . 0.0 109.802 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 26.1 mt-10 -57.01 -48.19 79.06 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.23 -0.919 . . . . 0.0 109.424 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.861 HG21 ' CE ' ' A' ' 79' ' ' MET . 4.7 t -76.23 -9.7 58.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.278 -0.889 . . . . 0.0 109.977 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.651 HD11 ' CD1' ' A' ' 76' ' ' PHE . 16.7 mt -87.27 3.05 48.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.491 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 61' ' ' ASP . 17.8 p-10 -85.46 114.59 22.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.17 -0.956 . . . . 0.0 109.47 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -52.45 -22.0 4.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.506 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 176.99 40.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.91 . . . . 0.0 109.472 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.419 ' O ' ' CG ' ' A' ' 65' ' ' ASP . . . 77.63 90.36 0.32 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 176.28 -32.46 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.277 -1.131 . . . . 0.0 108.579 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.12 -22.36 23.16 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mm-40 -70.01 106.94 3.4 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -1.115 . . . . 0.0 109.389 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 14.2 t -69.92 157.08 38.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 109.679 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.506 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 34.3 t0 -117.58 171.26 8.13 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -58.74 -50.3 74.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.479 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 2.3 mp0 -56.81 -40.22 75.57 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.819 . . . . 0.0 108.983 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 mt-10 -76.63 -17.15 59.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.428 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.476 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 26.4 t80 -71.54 -49.56 39.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.19 -0.944 . . . . 0.0 108.966 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.936 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mmt -66.04 -54.31 27.45 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.312 -0.867 . . . . 0.0 109.034 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.63 -26.3 66.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.24 -0.913 . . . . 0.0 108.999 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CD1' HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.25 -68.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 39' ' ' GLU . 53.4 t -62.75 -20.53 25.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.835 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -69.19 -30.86 69.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.447 -0.783 . . . . 0.0 109.269 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.861 ' CE ' HG21 ' A' ' 59' ' ' THR . 20.7 mtp -85.47 -67.53 0.8 Allowed 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.838 0.827 . . . . 0.0 109.072 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.946 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.15 -22.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 O-C-N 120.4 -1.438 . . . . 0.0 109.505 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.57 ' CA ' HD21 ' A' ' 40' ' ' LEU . 45.2 m -85.15 -61.1 1.85 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.007 -1.058 . . . . 0.0 108.468 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.554 HG21 ' CB ' ' B' ' 70' ' ' PHE . 1.4 m -80.28 -55.27 5.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.32 -42.12 0.19 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.276 0.56 . . . . 0.0 109.933 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 87' ' ' PHE . 30.4 t -69.03 -58.88 3.51 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.912 . . . . 0.0 109.463 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.421 ' C ' ' O ' ' A' ' 84' ' ' CYS . 2.1 t60 -44.5 -64.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -49.12 -36.02 17.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.45 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.309 -0.869 . . . . 0.0 109.474 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.489 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 58.4 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.73 -74.9 0.08 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.291 -0.881 . . . . 0.0 109.488 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 1.027 HD11 HG21 ' A' ' 13' ' ' VAL . 3.3 mp -71.16 -28.08 64.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.941 . . . . 0.0 109.488 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.489 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 34.4 tt0 -58.13 -58.3 9.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.394 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -59.49 -50.97 71.85 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.88 . . . . 0.0 109.336 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.655 ' O ' HD12 ' B' ' 10' ' ' LEU . . . -61.88 -14.78 37.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.447 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.473 ' HG3' ' OE2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -76.39 -53.64 7.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.425 ' H ' HG23 ' B' ' 8' ' ' VAL . 2.7 t -62.62 -27.69 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.705 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -80.17 -69.86 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 1.069 HD23 HD13 ' A' ' 3' ' ' LEU . 12.1 mt -44.4 -53.17 7.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 109.487 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.752 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 22.1 mm -55.61 -58.22 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 109.886 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -51.4 -19.92 1.56 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.034 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 1.002 HG13 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -88.58 -36.28 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.034 -1.041 . . . . 0.0 109.595 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.553 ' CD1' ' HB2' ' B' ' 73' ' ' PHE . 27.3 t80 -58.86 -41.64 87.49 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.777 -1.202 . . . . 0.0 108.837 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' B' ' 16' ' ' GLN . 0.3 OUTLIER -80.7 -46.25 15.84 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.334 -0.853 . . . . 0.0 109.252 179.727 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' B' ' 15' ' ' HIS . 1.7 tt0 -44.72 -40.17 5.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 108.685 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.521 ' O ' ' N ' ' B' ' 19' ' ' GLY . 3.9 m-85 -91.36 -79.23 0.37 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.546 ' HA ' HD23 ' B' ' 27' ' ' LEU . 32.2 t 37.0 29.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.242 0.544 . . . . 0.0 110.042 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' B' ' 31' ' ' GLU . . . 74.79 51.78 7.66 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -63.49 -10.01 15.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.328 -1.101 . . . . 0.0 109.814 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -93.18 69.91 4.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.998 . . . . 0.0 109.382 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.92 -42.16 1.49 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.459 ' O ' ' O ' ' B' ' 19' ' ' GLY . 1.1 m-20 -141.36 -153.3 0.45 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -1.174 . . . . 0.0 109.455 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.431 ' C ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -176.75 43.13 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.541 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.47 ' N ' ' OG ' ' B' ' 18' ' ' SER . 0.7 OUTLIER -122.44 -16.61 7.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.264 -0.897 . . . . 0.0 109.688 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.07 170.21 7.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.263 -0.898 . . . . 0.0 109.349 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' B' ' 18' ' ' SER . 12.6 mt -84.94 137.96 32.79 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 2.0 ptmt -109.67 73.12 0.83 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.225 -0.922 . . . . 0.0 109.504 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.4 tttm 61.54 -85.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.4 -0.813 . . . . 0.0 110.037 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 1.7 t -45.63 -39.43 7.75 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.134 -0.978 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.532 ' HB3' HD22 ' B' ' 27' ' ' LEU . 3.2 mm-40 -47.96 -50.12 28.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.94 -1.1 . . . . 0.0 108.745 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.756 HD21 ' CE2' ' B' ' 76' ' ' PHE . 1.1 mt -59.14 -55.76 30.89 Favored 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.712 ' HD3' HG11 ' B' ' 53' ' ' VAL . 7.7 mttp -42.56 -33.82 0.76 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.436 -0.79 . . . . 0.0 109.595 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -71.7 -66.14 0.67 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.683 -179.768 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 1.002 HD21 HG13 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -41.98 -60.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.363 -0.835 . . . . 0.0 110.231 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.527 ' HA ' ' CD1' ' B' ' 40' ' ' LEU . 80.7 mt -57.4 -53.55 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.326 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.772 HD22 HD11 ' B' ' 47' ' ' ILE . 1.2 m-20 -83.39 15.99 2.75 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.132 -0.98 . . . . 0.0 110.36 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.527 ' N ' ' O ' ' B' ' 34' ' ' GLU . 22.6 t30 -135.7 4.28 3.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.531 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 4.7 mp0 -133.19 -37.31 0.98 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.101 -0.999 . . . . 0.0 109.49 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.527 ' CD1' ' HA ' ' B' ' 36' ' ' ILE . 5.4 mp -75.7 -54.71 6.53 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.15 -0.969 . . . . 0.0 109.407 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.465 0 O-C-N 121.293 -0.88 . . . . 0.0 109.223 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.772 HD11 HD22 ' B' ' 37' ' ' ASN . 1.6 mt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.6 ptpt -43.35 -32.48 0.83 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.522 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' B' ' 49' ' ' GLU . 4.0 pt-20 179.01 54.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.258 -0.901 . . . . 0.0 109.498 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.597 ' HA ' HG21 ' B' ' 47' ' ' ILE . 1.8 mt-30 48.45 53.8 11.46 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' B' ' 55' ' ' LYS . 0.5 OUTLIER -90.21 -70.09 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.285 -0.884 . . . . 0.0 109.798 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 1.025 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -86.49 -20.2 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 109.75 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.712 HG11 ' HD3' ' B' ' 33' ' ' LYS . 25.4 t -80.71 -36.92 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.056 -1.027 . . . . 0.0 108.892 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.538 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 36.6 t70 -81.6 -28.84 33.55 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.009 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 0.9 OUTLIER -77.66 -43.32 31.7 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.339 -0.85 . . . . 0.0 109.238 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.788 HG13 ' O ' ' B' ' 52' ' ' VAL . 15.8 m -57.04 -51.76 64.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 121.181 -0.949 . . . . 0.0 109.656 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.559 ' N ' HG23 ' B' ' 56' ' ' VAL . 1.7 tpt -40.19 -28.42 0.06 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.116 -0.99 . . . . 0.0 109.752 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' B' ' 56' ' ' VAL . 3.7 mt-10 -77.91 -48.4 16.45 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.065 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.48 ' O ' ' C ' ' B' ' 60' ' ' LEU . 38.8 m -74.55 -63.16 1.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.292 -0.88 . . . . 0.0 109.354 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 1.077 HD22 ' CD1' ' B' ' 76' ' ' PHE . 10.5 mt -34.95 -36.81 0.06 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.298 0.57 . . . . 0.0 110.128 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' B' ' 59' ' ' THR . 10.3 t70 -81.89 73.58 8.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 -87.57 -27.04 22.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.88 . . . . 0.0 109.489 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -82.25 -51.5 7.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.902 . . . . 0.0 109.488 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.97 90.72 2.13 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -175.49 -35.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -1.146 . . . . 0.0 108.595 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.62 38.46 2.22 Favored Glycine 0 N--CA 1.485 1.964 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NZ ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -153.63 108.06 3.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.315 -1.109 . . . . 0.0 109.493 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.545 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 75.1 m -69.64 156.06 39.54 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.342 -0.849 . . . . 0.0 109.898 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.455 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 8.5 m-20 -117.43 170.29 8.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.358 -0.839 . . . . 0.0 108.944 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.752 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -48.83 -67.43 0.27 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 111.319 -179.385 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.522 ' NE2' ' HG2' ' B' ' 72' ' ' GLU . 1.5 pp0? -44.21 -27.81 0.45 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.21 -0.931 . . . . 0.0 108.955 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.612 ' O ' ' CD1' ' B' ' 76' ' ' PHE . 4.6 mt-10 -77.38 -43.2 33.6 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.407 -0.808 . . . . 0.0 109.809 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.879 ' HE1' HD22 ' B' ' 35' ' ' LEU . 12.6 t80 -49.15 -49.18 43.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.925 -1.11 . . . . 0.0 108.988 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.835 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 6.4 mtt -64.0 -41.31 97.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.437 -0.789 . . . . 0.0 109.381 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -66.42 -16.3 63.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.269 -0.894 . . . . 0.0 108.747 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 1.077 ' CD1' HD22 ' B' ' 60' ' ' LEU . 13.3 m-30 -75.5 -70.25 0.44 Allowed 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD12 ' A' ' 3' ' ' LEU . 39.4 t -52.64 -24.89 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.936 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -64.4 -48.04 76.91 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.37 -0.831 . . . . 0.0 109.36 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.681 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 67.0 mtp -74.74 -67.54 0.63 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -0.888 . . . . 0.0 109.841 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 1.025 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.99 -23.44 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 120.435 -1.416 . . . . 0.0 109.704 -178.924 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.891 HG21 HD11 ' A' ' 11' ' ' ILE . 7.8 m -80.28 -68.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.906 -1.121 . . . . 0.0 108.795 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.5 t -77.65 -49.33 14.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.179 -0.951 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.46 -37.1 0.18 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.261 0.553 . . . . 0.0 109.791 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 3.1 t -90.05 -35.34 15.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 0.0 109.505 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.0 OUTLIER -65.79 -9.99 33.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -70.68 -21.06 62.63 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 t80 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.249 -0.907 . . . . 0.0 109.504 179.994 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.838 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -70.22 -51.94 27.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.296 -0.878 . . . . 0.0 109.306 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.012 HD22 ' OE1' ' B' ' 39' ' ' GLU . 2.0 mp -72.41 -29.45 63.74 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 7' ' ' MET . 1.2 tt0 -58.74 -64.5 0.91 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.197 -0.939 . . . . 0.0 109.312 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -43.57 98.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.208 -0.932 . . . . 0.0 109.265 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -68.41 -9.99 52.19 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.448 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.471 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -83.64 -52.71 6.22 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.917 . . . . 0.0 109.403 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.01 -20.36 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.862 . . . . 0.0 109.444 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.515 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -83.59 -60.21 2.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.213 -0.93 . . . . 0.0 109.639 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.869 HD22 HD23 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -54.7 -38.46 67.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.591 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.741 HD11 HG21 ' B' ' 81' ' ' THR . 36.6 mt -68.17 -57.71 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.566 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -56.49 -19.05 13.52 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.277 -0.889 . . . . 0.0 109.46 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.896 HG11 HD21 ' B' ' 3' ' ' LEU . 0.8 OUTLIER -88.38 -29.9 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.138 -0.977 . . . . 0.0 109.253 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 73' ' ' PHE . 6.0 t80 -66.2 -41.4 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.051 -1.03 . . . . 0.0 109.075 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.658 ' CE1' ' CD2' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -78.46 -43.42 27.21 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.884 . . . . 0.0 109.388 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.63 -55.65 20.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -0.925 . . . . 0.0 109.447 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.518 ' HE1' HG22 ' A' ' 13' ' ' VAL . 20.9 m-85 -60.4 -43.75 96.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 109.532 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 5.5 p -56.92 -22.12 35.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.47 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.467 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -71.23 -35.93 63.78 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 19' ' ' GLY . 42.0 mmm-85 -43.96 -47.14 8.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -1.108 . . . . 0.0 109.464 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' A' ' 22' ' ' GLY . 3.4 tm-20 -70.42 154.67 41.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.461 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.23 -26.41 0.92 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.67 -149.8 0.18 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -174.26 65.6 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.275 -0.891 . . . . 0.0 109.425 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.658 ' CD2' ' CE1' ' A' ' 15' ' ' HIS . 7.3 m80 -169.28 -35.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.576 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' N ' ' HB2' ' A' ' 18' ' ' SER . 22.6 mtmt -129.34 159.6 35.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -0.906 . . . . 0.0 109.492 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.963 HD23 ' C ' ' A' ' 31' ' ' GLU . 7.3 mp -95.2 167.11 11.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 109.454 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -134.39 79.95 1.83 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.552 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.721 ' H ' HD13 ' A' ' 32' ' ' LEU . 4.1 ttmt 61.81 -85.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 110.3 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.428 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 6.8 m -44.68 -49.65 10.3 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 0.0 110.435 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.963 ' C ' HD23 ' A' ' 27' ' ' LEU . 63.9 mm-40 -63.11 -34.46 77.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.029 -1.045 . . . . 0.0 109.716 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.113 HD23 HD13 ' A' ' 60' ' ' LEU . 1.9 mp -61.37 -70.19 0.2 Allowed 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.434 -0.791 . . . . 0.0 109.674 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 9.1 ttmt -42.43 -39.28 2.16 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.332 -0.855 . . . . 0.0 109.75 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -58.7 -56.64 19.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.8 HD21 HG13 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -46.85 -35.27 6.16 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 109.476 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.62 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 1.2 mp -72.31 -39.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.592 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 57.0 m-80 -78.66 -1.75 35.86 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.185 -0.947 . . . . 0.0 109.809 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.513 ' ND2' ' OH ' ' A' ' 17' ' ' TYR . 21.0 t-20 -107.45 -25.02 11.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.593 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.629 ' OE1' HD22 ' A' ' 40' ' ' LEU . 3.1 tm-20 -99.42 -44.97 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -0.929 . . . . 0.0 109.505 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.972 HD11 ' HA ' ' A' ' 81' ' ' THR . 3.6 mm? -56.11 -44.92 79.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.217 -0.927 . . . . 0.0 109.407 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.509 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.545 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.761 HD13 HG21 ' A' ' 53' ' ' VAL . 3.9 mp . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.3 0.571 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 pttt -149.57 -48.7 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.474 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.489 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 87.9 mt-10 -64.81 -10.84 31.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.365 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 0.8 OUTLIER 75.29 54.28 0.07 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.292 -0.88 . . . . 0.0 109.448 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.83 -70.4 0.68 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.251 -0.906 . . . . 0.0 109.606 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.914 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.2 t -92.03 -24.78 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.112 -0.993 . . . . 0.0 109.251 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.761 HG21 HD13 ' A' ' 47' ' ' ILE . 39.2 t -78.58 -18.57 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.0 109.36 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.6 t0 -87.69 -37.67 16.5 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.239 -0.913 . . . . 0.0 109.44 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -78.81 -39.21 36.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.782 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.0 m -65.08 -46.16 92.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -43.51 -25.74 0.17 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.117 -0.989 . . . . 0.0 110.144 -179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.8 OUTLIER -86.39 -47.15 9.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.074 -1.016 . . . . 0.0 109.892 -179.632 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . 1.01 HG21 ' HE3' ' A' ' 79' ' ' MET . 7.2 t -68.98 -9.76 53.92 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.226 -0.921 . . . . 0.0 109.828 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.113 HD13 HD23 ' A' ' 32' ' ' LEU . 6.7 mt -94.4 -68.57 0.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.504 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 57' ' ' MET . 49.7 p-10 -65.03 87.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.495 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -82.94 -9.34 59.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.15 -22.43 16.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.235 -0.916 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 79.9 69.14 1.42 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 26.6 t70 178.36 32.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.287 -1.125 . . . . 0.0 108.374 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.43 64.89 3.08 Favored Glycine 0 N--CA 1.482 1.721 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 6.0 mt-10 -143.9 84.81 1.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.317 -1.108 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 69' ' ' ASP . 16.0 t -69.95 157.08 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 109.724 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.84 171.85 7.78 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.753 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.33 -51.35 70.3 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.248 -0.907 . . . . 0.0 110.412 -179.601 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 72' ' ' GLU . 17.6 pt20 -57.27 -40.32 77.46 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.229 -0.92 . . . . 0.0 108.802 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mt-10 -77.36 -16.17 59.02 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.467 -0.77 . . . . 0.0 109.349 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 14' ' ' PHE . 56.9 t80 -70.38 -64.19 0.94 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.929 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 2.7 tpp -58.11 -43.38 87.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.2 -28.03 69.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.439 -0.788 . . . . 0.0 109.126 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.62 ' CZ ' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -62.34 -69.8 0.24 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 108.797 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.3 t -57.07 -22.78 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.975 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -57.69 -52.76 64.1 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.508 -0.745 . . . . 0.0 109.418 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . 1.01 ' HE3' HG21 ' A' ' 59' ' ' THR . 0.7 OUTLIER -73.94 -63.26 1.25 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.436 -0.79 . . . . 0.0 109.923 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.914 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -47.88 -22.14 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 O-C-N 120.314 -1.492 . . . . 0.0 109.378 -179.14 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.972 ' HA ' HD11 ' A' ' 40' ' ' LEU . 4.5 m -79.1 -67.77 0.72 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.01 -1.056 . . . . 0.0 108.863 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.57 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -79.43 -49.43 12.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.135 -0.978 . . . . 0.0 108.837 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.85 -34.88 0.12 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.678 -0.639 . . . . 0.0 109.694 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 30.7 t -82.31 -46.13 14.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.493 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -47.03 -25.11 0.75 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.232 -0.918 . . . . 0.0 109.49 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.55 -50.7 13.26 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 0.0 109.508 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.183 -0.948 . . . . 0.0 109.54 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.515 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -64.37 -78.66 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.894 . . . . 0.0 109.769 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.896 HD21 HG11 ' A' ' 13' ' ' VAL . 90.0 mt -63.01 -25.24 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.126 -0.983 . . . . 0.0 109.892 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.52 ' O ' ' CG ' ' B' ' 7' ' ' MET . 1.0 OUTLIER -69.8 -70.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.127 -0.983 . . . . 0.0 109.537 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -60.28 -17.7 44.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 109.466 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.704 ' HB1' HD23 ' A' ' 10' ' ' LEU . . . -85.79 -26.81 25.57 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -0.921 . . . . 0.0 109.765 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.546 ' O ' HD12 ' B' ' 11' ' ' ILE . 3.4 ptt? -78.87 -31.74 45.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.128 -0.983 . . . . 0.0 109.474 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.521 ' N ' ' HG3' ' B' ' 7' ' ' MET . 56.0 t -82.39 -39.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.202 -0.936 . . . . 0.0 109.386 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.838 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -66.85 -42.95 84.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.24 -0.913 . . . . 0.0 109.41 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.584 HD13 ' HB1' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -68.65 -62.56 1.33 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.671 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 85.7 mt -44.98 -41.75 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.181 -0.95 . . . . 0.0 109.209 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.515 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 23.0 t0 -58.83 -61.81 2.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.311 -0.868 . . . . 0.0 109.364 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.54 -25.45 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.337 -0.852 . . . . 0.0 109.434 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 4.3 t80 -72.32 -49.69 32.54 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.927 -1.108 . . . . 0.0 109.344 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -75.91 -9.99 59.06 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 110.013 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.515 ' CG ' ' O ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -90.2 -61.69 1.63 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.047 -1.033 . . . . 0.0 109.319 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.586 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 34.2 m-85 -57.98 -43.77 86.71 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.573 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.701 ' N ' HD21 ' B' ' 27' ' ' LEU . 2.7 p -74.64 -14.01 60.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.508 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.545 ' CA ' ' HG2' ' B' ' 24' ' ' LYS . . . -92.54 8.98 76.65 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.502 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 54.7 mtp85 -87.81 -59.88 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -1.15 . . . . 0.0 109.396 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.2 OUTLIER -80.33 170.11 16.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.298 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' B' ' 23' ' ' ASP . . . -52.01 89.46 0.01 OUTLIER Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' B' ' 22' ' ' GLY . 0.5 OUTLIER 162.39 -164.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -1.084 . . . . 0.0 109.365 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.545 ' HG2' ' CA ' ' B' ' 19' ' ' GLY . 0.0 OUTLIER 171.05 58.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.236 -0.915 . . . . 0.0 109.458 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 16.5 t60 -170.27 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.302 -0.874 . . . . 0.0 109.643 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.551 ' CE ' ' HB3' ' B' ' 67' ' ' GLU . 1.4 ptmt -127.03 166.03 18.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.202 -0.936 . . . . 0.0 109.574 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.701 HD21 ' N ' ' B' ' 18' ' ' SER . 20.7 mt -121.16 130.62 53.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.265 -0.897 . . . . 0.0 109.859 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' B' ' 29' ' ' LYS . 5.0 ttpt -69.6 155.54 40.33 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -39.98 -38.68 0.74 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.185 -0.947 . . . . 0.0 109.732 -179.464 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.33 -46.15 71.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.324 -0.86 . . . . 0.0 109.582 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.525 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -53.03 -44.62 67.5 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.021 -1.049 . . . . 0.0 108.352 179.62 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.702 ' CD1' HD22 ' B' ' 60' ' ' LEU . 3.6 mm? -51.78 -70.71 0.08 Allowed 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.615 ' HE3' HG21 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -37.28 -33.11 0.05 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.731 -0.606 . . . . 0.0 110.146 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.448 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -69.84 -61.03 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.137 -0.977 . . . . 0.0 109.635 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -53.04 -20.6 3.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.332 -0.855 . . . . 0.0 110.052 -179.627 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 1.055 HD12 HG22 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -82.42 -49.06 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.047 -1.033 . . . . 0.0 109.391 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -75.77 0.05 19.31 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.182 -0.949 . . . . 0.0 109.462 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.455 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 0.6 OUTLIER -118.73 -22.33 7.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.163 -0.96 . . . . 0.0 109.576 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 1.012 ' OE1' HD22 ' A' ' 3' ' ' LEU . 18.5 pt-20 -91.59 -45.07 8.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 1.0 HD22 ' CG ' ' B' ' 39' ' ' GLU . 0.8 OUTLIER -84.19 -50.6 7.75 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 108.616 179.348 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.423 ' OG ' ' C ' ' B' ' 40' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.591 -0.693 . . . . 0.0 109.657 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 1.006 HD13 HG23 ' B' ' 53' ' ' VAL . 12.0 mt . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 121.248 0.547 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.2 pttt -44.85 -27.38 0.51 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.215 -0.928 . . . . 0.0 108.819 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' B' ' 48' ' ' LYS . 10.5 pt-20 178.08 -32.23 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.494 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -165.05 28.02 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.388 -0.82 . . . . 0.0 109.251 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -69.16 -70.77 0.25 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.43 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 1.018 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -91.03 -9.89 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.11 -0.994 . . . . 0.0 109.009 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.055 HG22 HD12 ' B' ' 36' ' ' ILE . 10.6 t -84.85 -29.67 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.494 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 17.9 t0 -90.15 -28.88 18.64 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -84.93 -49.81 8.03 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.442 -0.786 . . . . 0.0 109.105 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.77 ' O ' HD12 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -63.06 -41.52 93.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.132 -0.98 . . . . 0.0 108.754 179.578 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.496 ' HB2' ' O ' ' B' ' 53' ' ' VAL . 0.9 OUTLIER -43.06 -46.09 5.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.481 -0.762 . . . . 0.0 109.238 179.605 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -60.66 -48.25 82.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.227 -0.92 . . . . 0.0 109.009 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.4 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 4.0 m -64.36 -13.95 53.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.352 -0.843 . . . . 0.0 109.196 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.788 HD21 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mp -92.25 -81.41 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.336 -0.853 . . . . 0.0 109.494 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.461 ' HA ' ' O ' ' B' ' 67' ' ' GLU . 46.1 p-10 -59.17 89.17 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' B' ' 60' ' ' LEU . 0.2 OUTLIER -103.01 -1.66 28.9 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.621 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.434 ' HB2' ' OE2' ' B' ' 67' ' ' GLU . 0.7 OUTLIER -81.54 -9.34 59.71 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.118 -0.989 . . . . 0.0 109.488 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.39 81.85 0.43 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.72 -32.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.242 -1.152 . . . . 0.0 108.635 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.08 37.34 1.84 Allowed Glycine 0 N--CA 1.486 1.981 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.551 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -129.61 149.25 51.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.258 -1.142 . . . . 0.0 109.467 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 10.2 t -95.58 155.61 16.67 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.699 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' B' ' 72' ' ' GLU . 17.2 t70 -121.39 171.18 8.95 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.671 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -60.26 -54.29 47.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.135 -0.978 . . . . 0.0 110.334 -179.554 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.779 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.7 pt20 -56.55 -21.72 28.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.086 -1.009 . . . . 0.0 108.815 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' B' ' 76' ' ' PHE . 14.9 mm-40 -84.61 -30.46 24.94 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.559 -0.713 . . . . 0.0 109.159 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.736 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 37.1 t80 -62.85 -47.03 85.14 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.407 -0.808 . . . . 0.0 109.083 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.975 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 3.1 mtt -70.33 -56.63 6.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.348 -0.845 . . . . 0.0 109.301 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.43 -16.08 21.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 108.928 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.788 ' HB2' HD21 ' B' ' 60' ' ' LEU . 2.5 t80 -72.49 -68.99 0.43 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.512 -0.742 . . . . 0.0 109.137 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.634 HG21 HD23 ' A' ' 3' ' ' LEU . 42.7 t -56.1 -27.92 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.259 -0.901 . . . . 0.0 109.162 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.929 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.16 -36.46 81.85 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.378 -0.826 . . . . 0.0 109.5 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.624 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.0 OUTLIER -77.08 -68.16 0.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 109.557 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 1.018 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.41 -24.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 O-C-N 120.606 -1.309 . . . . 0.0 109.068 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.741 HG21 HD11 ' A' ' 11' ' ' ILE . 8.8 m -76.77 -69.19 0.53 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.142 -0.974 . . . . 0.0 109.395 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.4 t -75.34 -49.55 18.76 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.04 -1.037 . . . . 0.0 108.922 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.38 -30.33 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.761 -0.587 . . . . 0.0 109.775 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' B' ' 82' ' ' THR . 15.7 t -81.4 -46.65 14.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.304 -0.872 . . . . 0.0 109.604 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.0 OUTLIER -67.36 -9.85 45.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -83.99 -15.78 46.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 109.598 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.892 . . . . 0.0 109.605 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.277 0.56 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.763 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 2.9 mm-40 -68.76 -48.94 62.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.241 -0.912 . . . . 0.0 109.272 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.915 HD11 HD21 ' B' ' 35' ' ' LEU . 5.5 mt -78.99 -23.3 44.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.31 -0.869 . . . . 0.0 109.423 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.71 -61.99 2.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.127 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.44 -41.72 96.4 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.292 -0.88 . . . . 0.0 109.183 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.526 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -70.94 -10.77 60.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.385 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.614 ' CE ' HD13 ' B' ' 40' ' ' LEU . 2.7 mtp -82.07 -54.84 4.97 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.197 -0.939 . . . . 0.0 109.289 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.503 ' HA ' HD12 ' A' ' 11' ' ' ILE . 31.5 t -62.21 -32.76 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.328 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.91 ' HB1' ' HG2' ' B' ' 2' ' ' GLU . . . -73.17 -65.9 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.272 -0.892 . . . . 0.0 109.527 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.707 ' CD2' HD23 ' B' ' 3' ' ' LEU . 4.7 mt -44.47 -34.53 2.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.207 -0.933 . . . . 0.0 109.335 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.503 HD12 ' HA ' ' A' ' 8' ' ' VAL . 54.6 mt -63.39 -52.24 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.921 . . . . 0.0 109.361 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.53 -19.81 40.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.229 -0.919 . . . . 0.0 109.222 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.91 HG11 HD21 ' B' ' 3' ' ' LEU . 1.3 t -83.4 -29.78 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.338 -0.851 . . . . 0.0 109.333 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 46.7 t80 -70.5 -42.71 70.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.918 -1.114 . . . . 0.0 109.138 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.33 -34.12 36.93 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.31 -0.869 . . . . 0.0 109.492 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.21 -62.13 1.58 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.206 -0.934 . . . . 0.0 109.445 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.575 ' CD2' ' HG ' ' A' ' 35' ' ' LEU . 28.2 m-85 -56.6 -47.22 80.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.304 -0.873 . . . . 0.0 109.413 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 4.6 p -70.0 -17.56 63.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.478 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.484 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -91.26 15.31 61.47 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.465 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.1 mmt85 -89.61 -43.19 10.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.25 -1.147 . . . . 0.0 109.483 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 20' ' ' ARG . 7.0 mt-10 -164.9 119.73 1.35 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.252 -0.905 . . . . 0.0 109.47 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.545 ' HA3' ' HZ1' ' A' ' 26' ' ' LYS . . . 143.12 -117.3 1.09 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 22.4 m-20 -115.48 -2.99 12.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -1.161 . . . . 0.0 109.671 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 0.6 OUTLIER 76.25 17.7 2.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 109.502 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -142.04 10.82 1.97 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 109.482 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.545 ' HZ1' ' HA3' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -170.14 167.36 8.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.196 -0.94 . . . . 0.0 109.499 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.94 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.3 mp -100.31 164.78 11.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -0.932 . . . . 0.0 109.442 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 1.7 ptmm? -128.4 74.85 1.58 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.25 -0.906 . . . . 0.0 109.479 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 32' ' ' LEU . 11.4 ttmt 61.83 -85.57 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.395 -0.816 . . . . 0.0 110.206 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.47 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -44.8 -48.41 10.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.94 ' C ' HD23 ' A' ' 27' ' ' LEU . 78.5 mm-40 -56.02 -40.55 73.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 109.302 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.831 HD22 HD23 ' A' ' 60' ' ' LEU . 38.8 mt -60.06 -69.97 0.19 Allowed 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.633 -0.667 . . . . 0.0 109.571 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.471 ' HG2' ' OD1' ' A' ' 37' ' ' ASN . 14.2 ttmt -42.54 -27.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.318 -0.864 . . . . 0.0 109.729 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' N ' ' OE1' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -66.54 -54.32 25.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 109.469 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.879 HD21 HG13 ' A' ' 13' ' ' VAL . 16.1 mt -53.49 -37.49 62.78 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.676 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.084 HD11 ' CE2' ' A' ' 76' ' ' PHE . 3.1 mm -69.0 -38.7 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.553 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' OD1' ' HG2' ' A' ' 33' ' ' LYS . 7.2 m120 -82.88 -6.63 59.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 109.661 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.422 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -99.69 -18.24 17.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.514 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.703 ' OE1' HG13 ' A' ' 77' ' ' VAL . 19.6 tt0 -111.04 -57.57 2.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.229 -0.919 . . . . 0.0 109.544 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.674 ' H ' HD12 ' A' ' 40' ' ' LEU . 6.3 mp -65.5 -53.69 38.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.267 -0.896 . . . . 0.0 109.52 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.336 -0.853 . . . . 0.0 109.329 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.764 HD11 ' CG1' ' A' ' 80' ' ' VAL . 1.6 mt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER -40.78 -25.81 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.434 -0.791 . . . . 0.0 109.678 -179.754 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -95.64 41.7 1.1 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.211 179.773 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 10.0 mt-30 45.9 48.12 12.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.899 . . . . 0.0 109.515 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -90.14 -70.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.288 -0.883 . . . . 0.0 109.536 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.926 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.7 t -92.37 -15.58 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.199 -0.938 . . . . 0.0 109.168 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.676 HG23 HG23 ' A' ' 47' ' ' ILE . 42.5 t -81.71 -23.57 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 108.896 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 1.1 t0 -86.19 -30.26 22.56 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.32 -0.862 . . . . 0.0 109.085 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -82.65 -46.15 13.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 0.0 109.217 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.784 HG22 ' O ' ' A' ' 52' ' ' VAL . 35.3 m -58.37 -43.79 87.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.181 -0.949 . . . . 0.0 109.544 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.563 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.2 -28.47 3.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.086 -1.009 . . . . 0.0 109.99 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 59' ' ' THR . 1.2 pp20? -82.58 -34.64 27.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.043 -1.036 . . . . 0.0 109.719 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.524 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 16.9 m -78.31 -64.84 1.07 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.177 -0.952 . . . . 0.0 109.267 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.092 HD21 ' CG ' ' A' ' 76' ' ' PHE . 8.8 mp -39.41 -31.6 0.09 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.608 -0.682 . . . . 0.0 109.791 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' THR . 0.4 OUTLIER -43.96 105.84 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 61' ' ' ASP . 18.9 t-20 -44.93 -48.53 11.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -178.61 31.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.245 -0.91 . . . . 0.0 109.575 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.02 90.78 1.54 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -175.82 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.286 -1.126 . . . . 0.0 108.509 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.24 27.21 6.62 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.534 ' HB2' ' CG ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -138.13 119.07 14.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.256 -1.143 . . . . 0.0 109.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.0 t -69.89 158.61 35.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.215 -0.928 . . . . 0.0 109.782 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.543 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.75 172.12 7.58 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 1.5 t80 -60.16 -56.2 24.51 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.885 . . . . 0.0 110.585 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.842 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -57.27 -31.18 65.34 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.886 . . . . 0.0 109.275 -179.431 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.543 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 0.1 OUTLIER -79.18 -23.9 43.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.392 -0.817 . . . . 0.0 108.986 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.817 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.9 t80 -65.34 -58.04 6.9 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.416 -0.802 . . . . 0.0 108.952 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.24 -41.57 93.44 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.26 -0.9 . . . . 0.0 109.028 179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.44 -26.07 68.56 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.081 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 1.092 ' CG ' HD21 ' A' ' 60' ' ' LEU . 2.1 t80 -67.79 -63.59 1.03 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.352 -0.843 . . . . 0.0 109.31 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.703 HG13 ' OE1' ' A' ' 39' ' ' GLU . 25.3 t -58.9 -25.42 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.315 -0.866 . . . . 0.0 108.963 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.856 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.27 -33.4 74.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.43 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.6 OUTLIER -81.7 -68.11 0.72 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.926 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -49.08 -21.01 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 O-C-N 120.546 -1.346 . . . . 0.0 110.114 -178.936 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.578 HG23 ' N ' ' A' ' 82' ' ' THR . 5.8 t -87.61 -49.73 6.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.675 -1.265 . . . . 0.0 108.901 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.584 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.1 m -90.57 -56.39 3.22 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -33.73 -34.16 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.313 0.578 . . . . 0.0 109.913 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.51 ' N ' ' O ' ' A' ' 82' ' ' THR . 41.0 t -79.03 -50.17 11.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.227 -0.921 . . . . 0.0 109.529 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.0 OUTLIER -53.78 -56.74 14.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.263 -0.898 . . . . 0.0 109.512 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.94 -19.76 61.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.562 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.0 t80 . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -179.985 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.91 ' HG2' ' HB1' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -63.86 -72.2 0.15 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.587 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.91 HD21 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -62.33 -23.13 66.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.335 -0.853 . . . . 0.0 109.696 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.404 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 4.0 tt0 -62.56 -62.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.443 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -26.82 68.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.208 -0.933 . . . . 0.0 109.27 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -74.93 -23.6 58.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 109.429 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -37.75 36.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.266 -0.896 . . . . 0.0 109.466 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.46 ' O ' HG22 ' B' ' 11' ' ' ILE . 74.8 t -71.07 -35.61 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.26 -0.9 . . . . 0.0 109.642 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -78.21 -56.66 4.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.184 -0.948 . . . . 0.0 109.564 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.771 HD23 HD22 ' A' ' 3' ' ' LEU . 3.5 mt -54.29 -47.03 72.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 109.595 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.828 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -58.22 -46.89 88.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.137 -0.977 . . . . 0.0 109.425 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.571 ' N ' HG23 ' B' ' 11' ' ' ILE . 2.6 m-20 -58.91 -22.74 60.24 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.138 -0.976 . . . . 0.0 109.492 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.845 HG11 HD11 ' A' ' 3' ' ' LEU . 1.1 t -85.56 -29.98 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.504 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 49.3 t80 -66.5 -42.24 87.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.798 -1.189 . . . . 0.0 109.246 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -76.83 -41.32 44.7 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -0.917 . . . . 0.0 109.534 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.62 -65.91 0.62 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 0.0 109.516 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.587 ' CD1' HG13 ' B' ' 13' ' ' VAL . 33.0 m-85 -50.75 -41.7 56.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 109.379 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.53 ' HB3' ' N ' ' B' ' 26' ' ' LYS . 1.4 m -88.32 43.05 1.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.276 -0.89 . . . . 0.0 109.468 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.14 -61.05 0.67 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -50.96 -20.62 1.41 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.377 -1.072 . . . . 0.0 110.005 -179.604 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' B' ' 28' ' ' LYS . 4.5 tm-20 -69.68 155.14 40.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.087 -1.008 . . . . 0.0 109.421 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . -43.2 -91.79 0.01 OUTLIER Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.306 -1.518 . . . . 0.0 109.306 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.531 ' O ' ' N ' ' B' ' 25' ' ' HIS . 1.5 m-20 -68.31 86.99 0.29 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.223 -1.163 . . . . 0.0 108.948 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 18' ' ' SER . 8.6 pttp -41.97 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.451 -0.781 . . . . 0.0 109.829 -179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 23' ' ' ASP . 1.0 OUTLIER -170.46 -35.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.244 -0.91 . . . . 0.0 109.706 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -128.25 164.63 22.15 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.766 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.7 HD22 HD23 ' B' ' 32' ' ' LEU . 7.5 mp -90.56 164.55 14.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.34 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -131.32 74.35 1.59 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.325 -0.86 . . . . 0.0 109.346 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER 63.54 -83.21 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.607 -0.683 . . . . 0.0 110.363 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.465 ' O ' ' OE1' ' B' ' 34' ' ' GLU . 1.4 t -45.02 -44.55 10.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.147 -0.97 . . . . 0.0 110.591 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.678 ' C ' HD23 ' B' ' 27' ' ' LEU . 19.9 mm-40 -61.87 -39.32 91.5 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.76 -1.213 . . . . 0.0 108.718 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.7 HD23 HD22 ' B' ' 27' ' ' LEU . 28.9 mt -55.35 -70.31 0.11 Allowed 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 1.03 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -44.45 -28.12 0.53 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.885 . . . . 0.0 109.731 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -67.72 -68.36 0.39 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.126 -0.984 . . . . 0.0 109.558 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.915 HD21 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -41.72 -49.32 4.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.389 -0.819 . . . . 0.0 109.862 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.614 HD12 HG21 ' B' ' 80' ' ' VAL . 6.4 mm -56.0 -58.79 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.155 -0.965 . . . . 0.0 109.567 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.523 ' OD1' ' CG1' ' B' ' 47' ' ' ILE . 0.7 OUTLIER -85.06 15.19 4.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.0 109.844 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' B' ' 34' ' ' GLU . 5.2 m-20 -116.63 -8.97 11.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.473 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.527 ' HG2' ' CG ' ' A' ' 3' ' ' LEU . 12.5 mp0 -133.78 -44.38 0.81 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.614 HD13 ' CE ' ' A' ' 7' ' ' MET . 3.8 mm? -56.49 -62.7 1.55 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.212 -0.93 . . . . 0.0 109.202 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.699 . . . . 0.0 110.62 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.809 HG13 HG21 ' B' ' 53' ' ' VAL . 1.5 mm . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.485 ' CE ' ' OE2' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -43.38 -48.2 6.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.478 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -158.51 58.09 0.45 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.231 -0.918 . . . . 0.0 109.278 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.543 ' N ' HG22 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 62.35 36.23 14.58 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.257 -0.902 . . . . 0.0 109.294 -179.856 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' B' ' 48' ' ' LYS . 3.1 tt0 -65.18 -70.14 0.25 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.338 -0.851 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.924 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.5 t -88.57 -15.67 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.221 -0.925 . . . . 0.0 109.414 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.03 HG11 ' HG3' ' B' ' 33' ' ' LYS . 52.3 t -78.93 -30.38 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.087 -1.008 . . . . 0.0 108.927 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 21.0 t0 -82.82 -36.86 25.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.291 -0.881 . . . . 0.0 109.069 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -72.01 -47.43 51.98 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 0.0 109.208 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.861 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 33.9 m -59.84 -45.73 94.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 O-C-N 121.252 -0.905 . . . . 0.0 109.391 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.592 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.22 -24.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.878 -1.139 . . . . 0.0 109.977 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.8 tt0 -88.29 -45.86 9.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.11 -0.993 . . . . 0.0 110.377 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.758 HG21 ' SD ' ' B' ' 79' ' ' MET . 8.5 t -69.82 -52.91 21.0 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.913 -1.117 . . . . 0.0 110.003 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.751 HD21 ' CG ' ' B' ' 76' ' ' PHE . 5.6 mt -44.81 -65.27 0.55 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.986 -1.071 . . . . 0.0 109.093 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -45.55 102.61 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 109.496 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.54 11.06 7.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' HB2' ' B' ' 65' ' ' ASP . 3.4 p30 -111.39 -13.69 13.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 109.438 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.89 77.34 1.0 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.431 ' HB2' ' OD1' ' B' ' 63' ' ' ASP . 0.4 OUTLIER 178.14 -33.24 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.222 -1.163 . . . . 0.0 108.632 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.19 4.66 29.04 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.491 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 2.3 mm-40 -98.15 137.81 36.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -1.177 . . . . 0.0 109.446 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.5 t -79.33 159.21 27.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.169 -0.957 . . . . 0.0 109.639 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.503 ' CB ' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -125.69 171.51 10.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.378 -0.826 . . . . 0.0 108.82 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.8 OUTLIER -58.03 -53.31 59.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.224 -0.923 . . . . 0.0 110.27 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.642 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 26.4 mt-30 -58.16 -30.36 66.32 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.358 -0.839 . . . . 0.0 109.025 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.503 ' HG3' ' CB ' ' B' ' 69' ' ' ASP . 6.2 mt-10 -80.44 -22.02 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.433 -0.792 . . . . 0.0 109.278 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.478 ' HB2' ' CD1' ' B' ' 14' ' ' PHE . 2.8 t80 -69.26 -61.77 1.65 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.286 -0.884 . . . . 0.0 108.795 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.856 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -57.9 -42.51 84.85 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -61.85 -28.79 69.74 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.861 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.7 OUTLIER -64.31 -69.64 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.442 -0.786 . . . . 0.0 108.985 179.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' B' ' 81' ' ' THR . 43.1 t -51.93 -26.55 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.307 -0.87 . . . . 0.0 108.804 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -65.93 -42.97 89.4 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.37 -0.831 . . . . 0.0 109.432 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.758 ' SD ' HG21 ' B' ' 59' ' ' THR . 26.2 mtm -77.89 -69.56 0.54 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.266 -0.896 . . . . 0.0 109.568 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.924 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.69 -24.15 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 O-C-N 120.683 -1.261 . . . . 0.0 110.026 -178.795 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 23.0 m -82.52 -65.69 0.98 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.854 -1.154 . . . . 0.0 108.594 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.1 m -75.59 -54.58 6.77 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -34.89 -46.74 0.32 Allowed 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.213 0.53 . . . . 0.0 110.186 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 54.0 t -64.71 -49.74 69.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.213 -0.929 . . . . 0.0 109.585 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -16.88 35.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.892 . . . . 0.0 109.548 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -90.1 -27.02 19.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.926 . . . . 0.0 109.504 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.546 -179.988 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.773 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -69.71 -60.87 2.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.307 -0.871 . . . . 0.0 109.438 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.989 HD23 HG21 ' B' ' 77' ' ' VAL . 5.9 mp -66.32 -21.67 66.26 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.293 -0.88 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 25.9 mm-40 -63.99 -67.08 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.288 -0.882 . . . . 0.0 109.26 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.529 ' O ' HG12 ' A' ' 8' ' ' VAL . 10.1 mmtt -59.53 -44.89 93.07 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.212 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.656 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -62.86 -20.94 65.6 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.31 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.476 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 59.5 ttp -72.9 -53.03 12.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.314 -0.866 . . . . 0.0 109.334 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.529 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -64.15 -20.86 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.202 -0.937 . . . . 0.0 109.41 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.696 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -80.84 -69.99 0.56 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 109.748 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.515 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.3 OUTLIER -50.64 -48.54 58.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.65 -179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 1.2 mp -58.58 -50.23 79.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.158 -0.964 . . . . 0.0 109.101 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 45.0 t0 -60.53 -19.15 56.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.108 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.923 HG11 HD11 ' B' ' 3' ' ' LEU . 2.2 t -86.98 -26.17 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.078 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -70.45 -46.15 64.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.025 -1.047 . . . . 0.0 109.109 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -77.68 -34.22 53.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.393 -0.817 . . . . 0.0 109.625 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -69.22 -64.48 0.86 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.0 109.383 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.785 ' CG ' HD21 ' A' ' 35' ' ' LEU . 12.0 m-85 -51.25 -53.0 39.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 23' ' ' ASP . 1.4 t -63.7 -25.12 68.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.275 -0.891 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -54.92 -20.26 18.62 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -90.13 -29.44 18.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.256 -1.143 . . . . 0.0 109.658 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -83.35 69.94 10.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -0.931 . . . . 0.0 109.654 -179.838 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 47.02 96.7 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.4 OUTLIER 73.14 -149.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -1.177 . . . . 0.0 109.395 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.22 96.83 2.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.253 -0.905 . . . . 0.0 109.515 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.496 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 34.3 m-70 -145.63 -46.79 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 109.642 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 mttt -137.03 170.21 16.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 109.621 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 1.059 HD13 HD11 ' A' ' 35' ' ' LEU . 85.1 mt -115.5 131.33 56.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.191 -0.943 . . . . 0.0 109.558 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.813 ' O ' HD12 ' A' ' 32' ' ' LEU . 2.8 ptmt -76.78 164.03 26.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.206 -0.934 . . . . 0.0 108.768 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -27.18 0.14 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.92 . . . . 0.0 109.828 -179.742 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.464 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 3.5 m -77.45 -52.58 8.86 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 110.216 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.82 ' HB3' HD22 ' A' ' 27' ' ' LEU . 19.1 mm-40 -55.03 -39.1 68.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.307 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.061 HD13 ' CE ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -62.56 -70.17 0.22 Allowed 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.544 -0.723 . . . . 0.0 109.431 179.794 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.809 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -43.03 -26.61 0.15 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.165 -0.96 . . . . 0.0 109.586 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.492 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -71.4 -51.58 23.25 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.116 -0.99 . . . . 0.0 109.455 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.059 HD11 HD13 ' A' ' 27' ' ' LEU . 2.3 mt -60.15 -51.19 70.64 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.311 -0.868 . . . . 0.0 109.856 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.988 ' CD1' HG21 ' A' ' 80' ' ' VAL . 89.8 mt -62.08 -34.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 109.588 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.813 HD22 HG12 ' A' ' 47' ' ' ILE . 5.0 m120 -92.46 -0.95 57.3 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.679 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 34' ' ' GLU . 0.8 OUTLIER -93.83 -43.44 8.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.54 ' CG ' ' HB2' ' B' ' 3' ' ' LEU . 54.5 mp0 -122.7 -10.06 8.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.31 -0.869 . . . . 0.0 109.4 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 36' ' ' ILE . 2.0 mp -108.6 -6.82 15.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HB3' ' HA ' ' A' ' 37' ' ' ASN . 1.9 p . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.199 -0.938 . . . . 0.0 109.478 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.813 HG12 HD22 ' A' ' 37' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.484 ' HE2' ' HB2' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -43.51 -26.88 0.24 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 109.534 -179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 47' ' ' ILE . 1.3 tp10 176.79 55.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.535 ' HA ' HG21 ' A' ' 47' ' ' ILE . 13.1 mt-30 57.96 35.46 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.274 -0.891 . . . . 0.0 109.295 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -71.65 -70.15 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.239 -0.913 . . . . 0.0 109.756 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 1.012 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.3 t -83.42 -11.06 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.067 -1.02 . . . . 0.0 109.68 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.809 HG11 ' HD3' ' A' ' 33' ' ' LYS . 43.0 t -84.23 -37.43 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.828 -1.17 . . . . 0.0 108.32 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.2 t0 -90.2 -22.1 21.84 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 5.0 mttm -87.49 -48.42 7.96 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.488 -0.757 . . . . 0.0 109.207 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.869 HG22 HD21 ' A' ' 60' ' ' LEU . 1.2 p -64.19 -42.63 96.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 O-C-N 121.179 -0.951 . . . . 0.0 109.094 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' MET . . . . . 1.061 ' CE ' HD13 ' A' ' 32' ' ' LEU . 10.7 tpp -43.48 -45.49 6.45 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 5.4 tt0 -61.22 -44.17 97.7 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.236 -0.915 . . . . 0.0 108.827 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.0 m -62.55 -18.92 63.05 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.372 -0.83 . . . . 0.0 109.411 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.869 HD21 HG22 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -91.5 28.82 1.61 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.196 -0.94 . . . . 0.0 108.898 179.571 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 6.6 t0 -85.99 98.48 10.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.489 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.9 -23.33 14.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -140.22 9.71 2.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.261 -0.899 . . . . 0.0 109.47 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.425 ' HA2' ' OD1' ' A' ' 61' ' ' ASP . . . 69.03 83.62 0.16 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 178.8 -33.55 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.22 -1.164 . . . . 0.0 108.576 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 14.52 13.32 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 3.3 pt-20 -87.28 114.93 24.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.3 -1.118 . . . . 0.0 109.469 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.599 ' HB2' HD21 ' A' ' 32' ' ' LEU . 18.8 t -69.74 157.79 36.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -120.69 172.15 8.08 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.526 ' CZ ' HG13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.73 -55.96 16.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.085 -1.009 . . . . 0.0 110.129 -179.81 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.497 ' HG3' ' N ' ' A' ' 72' ' ' GLU . 8.4 pt20 -62.14 -39.4 92.46 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 tt0 -78.68 -10.43 59.75 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.574 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 34.2 t80 -73.73 -51.44 16.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.562 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -64.69 -46.99 80.02 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.03 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -68.32 -20.75 64.77 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.319 -0.863 . . . . 0.0 109.012 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.705 ' CE1' HD11 ' A' ' 36' ' ' ILE . 4.6 t80 -66.68 -70.39 0.25 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.192 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' B' ' 3' ' ' LEU . 81.5 t -60.18 -30.38 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.236 -0.915 . . . . 0.0 108.934 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.651 ' HB2' ' CG ' ' B' ' 74' ' ' MET . . . -60.29 -41.99 94.53 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.415 -0.803 . . . . 0.0 109.196 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.657 ' HE2' HG23 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -63.33 -50.74 68.81 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.163 -0.961 . . . . 0.0 108.701 179.503 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 1.012 ' HA ' HG11 ' A' ' 52' ' ' VAL . 1.5 t -65.33 -9.53 7.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.696 0 O-C-N 121.085 -1.009 . . . . 0.0 109.583 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.939 HG21 ' SD ' ' B' ' 7' ' ' MET . 52.7 m -86.85 -57.76 2.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.223 -0.923 . . . . 0.0 109.382 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -81.91 -48.81 11.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.162 -0.961 . . . . 0.0 109.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.584 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.42 -42.65 1.12 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.704 -0.622 . . . . 0.0 109.871 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.16 -51.3 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.903 . . . . 0.0 109.519 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -74.2 -9.98 59.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 109.497 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 83' ' ' ALA . 3.2 mt-10 -75.07 -34.86 61.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' A' ' 86' ' ' GLU . 4.3 t80 . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 109.593 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.534 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.696 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 3.6 mm-40 -76.13 -35.85 59.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 109.3 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.923 HD11 HG11 ' A' ' 13' ' ' VAL . 7.5 mp -78.99 -28.1 43.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.285 -0.885 . . . . 0.0 109.442 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.534 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 4.9 tm-20 -68.84 -58.84 3.6 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.899 . . . . 0.0 109.192 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.595 ' O ' HG12 ' B' ' 8' ' ' VAL . 19.4 mttt -62.61 -37.2 85.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.223 -0.923 . . . . 0.0 109.161 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.602 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -66.9 -19.52 65.74 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.38 -0.825 . . . . 0.0 109.308 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.939 ' SD ' HG21 ' A' ' 81' ' ' THR . 10.4 tpt -81.84 -38.47 25.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.342 -0.849 . . . . 0.0 109.368 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.595 HG12 ' O ' ' B' ' 5' ' ' LYS . 2.6 p -68.27 -30.89 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.286 -0.884 . . . . 0.0 109.413 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.773 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -82.47 -52.46 6.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 109.395 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.661 HD12 ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -53.29 -40.87 65.07 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.813 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -68.86 -46.37 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.376 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.58 ' N ' HG23 ' B' ' 11' ' ' ILE . 0.3 OUTLIER -51.89 -26.83 11.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 109.239 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 1.014 HG13 ' CD1' ' B' ' 17' ' ' TYR . 18.9 t -86.81 -30.87 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.26 -0.9 . . . . 0.0 109.366 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 2.7 t80 -59.48 -56.92 15.92 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.834 -1.166 . . . . 0.0 109.027 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.726 ' CD2' ' HB2' ' B' ' 24' ' ' LYS . 5.5 t-80 -72.79 -48.41 38.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 109.636 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 44.9 tt0 -50.5 -68.39 0.18 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.841 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 1.014 ' CD1' HG13 ' B' ' 13' ' ' VAL . 25.4 m-85 -52.97 -32.77 47.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 110.072 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 86.3 p -87.36 31.57 0.73 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.044 -1.035 . . . . 0.0 109.942 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.02 -0.34 48.21 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.87 -58.27 2.63 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -1.17 . . . . 0.0 109.49 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.49 168.58 18.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.229 -0.92 . . . . 0.0 109.477 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.17 -105.88 3.17 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' B' ' 24' ' ' LYS . 0.2 OUTLIER -148.97 -68.67 0.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -1.143 . . . . 0.0 109.476 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.726 ' HB2' ' CD2' ' B' ' 15' ' ' HIS . 2.8 pttt 168.8 39.32 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.91 . . . . 0.0 109.503 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.574 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 3.9 p80 -169.74 27.53 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.713 ' O ' HD23 ' B' ' 27' ' ' LEU . 4.5 ptpt -153.97 167.66 29.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' B' ' 31' ' ' GLU . 78.9 mt -138.34 119.2 14.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.226 -0.921 . . . . 0.0 109.874 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.0 OUTLIER -85.77 118.86 25.53 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.279 -0.888 . . . . 0.0 108.666 179.114 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.535 ' N ' ' CE ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER 20.1 -78.76 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' B' ' 28' ' ' LYS . 69.3 p -40.73 -58.42 1.65 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.979 -1.075 . . . . 0.0 110.794 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.799 ' HB3' HD22 ' B' ' 27' ' ' LEU . 31.1 mm-40 -45.93 -43.84 14.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.903 -1.123 . . . . 0.0 109.166 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' B' ' 27' ' ' LEU . 20.2 mt -53.26 -66.07 0.45 Allowed 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.56 -0.713 . . . . 0.0 109.12 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.619 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -43.62 -36.27 2.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 109.646 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -54.97 -63.08 1.27 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 109.416 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.733 HD11 ' CG1' ' B' ' 13' ' ' VAL . 1.1 mp -50.71 -36.66 37.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.58 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.962 HD13 HG22 ' B' ' 53' ' ' VAL . 4.1 mt -61.43 -39.27 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.706 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.765 HD21 HD11 ' B' ' 47' ' ' ILE . 0.7 OUTLIER -96.38 -70.08 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 109.679 -179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -45.72 -24.34 0.35 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.289 -0.882 . . . . 0.0 109.963 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.883 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -113.91 -40.8 3.67 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.077 -1.015 . . . . 0.0 109.941 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.703 ' CD1' HG13 ' B' ' 77' ' ' VAL . 0.1 OUTLIER -109.52 67.98 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.132 -0.98 . . . . 0.0 109.601 -179.821 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.455 179.928 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.765 HD11 HD21 ' B' ' 37' ' ' ASN . 31.1 mm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.2 OUTLIER 84.4 -52.15 0.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.712 -0.618 . . . . 0.0 109.592 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.522 ' N ' ' CG ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -174.21 34.96 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.5 ' HA ' HG21 ' B' ' 47' ' ' ILE . 5.8 mt-30 73.73 38.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -65.47 -70.26 0.25 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.178 -0.951 . . . . 0.0 109.394 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.879 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.4 t -87.56 -15.41 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.142 -0.974 . . . . 0.0 109.152 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.962 HG22 HD13 ' B' ' 36' ' ' ILE . 39.5 t -75.17 -29.83 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.204 -0.935 . . . . 0.0 108.746 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 6.1 t0 -90.13 -36.92 14.56 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.425 -0.797 . . . . 0.0 109.314 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.471 ' HA ' ' OE2' ' B' ' 58' ' ' GLU . 23.7 mtpp -70.63 -36.17 73.32 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.316 -0.865 . . . . 0.0 109.534 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.964 ' HB ' HD13 ' B' ' 60' ' ' LEU . 5.3 m -55.44 -56.13 13.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.642 ' H ' HG23 ' B' ' 56' ' ' VAL . 0.2 OUTLIER -41.11 -28.32 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.93 -1.106 . . . . 0.0 109.625 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.471 ' OE2' ' HA ' ' B' ' 55' ' ' LYS . 45.0 mt-10 -70.06 -55.6 9.09 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' B' ' 60' ' ' LEU . 2.8 m -82.81 -63.06 1.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 1.053 HD21 ' CG ' ' B' ' 76' ' ' PHE . 1.7 mp -37.2 -36.5 0.14 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.761 -0.587 . . . . 0.0 109.898 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.524 ' CB ' ' O ' ' B' ' 57' ' ' MET . 11.1 t0 -90.11 70.03 7.29 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.398 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -100.09 8.88 43.61 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.9 -10.74 17.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.468 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 63.85 78.39 0.19 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 58.8 t0 178.99 -33.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.25 -1.147 . . . . 0.0 108.602 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 -9.37 31.52 Favored Glycine 0 N--CA 1.486 1.973 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.432 ' HB2' ' HD3' ' B' ' 26' ' ' LYS . 12.2 pt-20 -95.56 123.74 39.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -1.148 . . . . 0.0 109.474 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -69.63 133.42 47.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.273 -0.892 . . . . 0.0 109.338 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 23.0 t70 -98.05 170.76 8.7 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -55.74 -47.7 76.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.042 . . . . 0.0 110.061 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.444 ' HG2' ' SD ' ' A' ' 79' ' ' MET . 65.6 mt-30 -50.56 -49.31 56.41 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.546 -0.721 . . . . 0.0 109.319 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.546 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -72.17 -20.83 61.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.541 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.661 ' CE2' HD12 ' B' ' 10' ' ' LEU . 71.8 t80 -59.86 -57.78 11.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.651 ' CG ' ' HB2' ' A' ' 78' ' ' ALA . 3.4 mtt -66.61 -44.14 82.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.332 -0.855 . . . . 0.0 109.605 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -68.61 -12.21 61.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.081 -1.012 . . . . 0.0 109.21 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 1.053 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -81.52 -70.52 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.337 -0.852 . . . . 0.0 109.282 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.989 HG21 HD23 ' A' ' 3' ' ' LEU . 98.5 t -60.59 -30.25 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.88 . . . . 0.0 108.858 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.562 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -66.16 -45.57 80.49 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.459 -0.776 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.643 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 4.3 mmm -63.17 -70.34 0.22 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.059 -1.026 . . . . 0.0 108.914 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.879 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -41.81 -26.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 120.891 -1.131 . . . . 0.0 109.553 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.535 ' HA ' HD21 ' B' ' 40' ' ' LEU . 15.2 m -71.05 -70.23 0.32 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.053 -1.03 . . . . 0.0 108.885 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.0 OUTLIER -79.23 -50.77 10.41 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.113 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.4 -37.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.262 0.553 . . . . 0.0 109.848 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 8.6 t -84.88 -39.53 18.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 109.557 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -65.38 -9.98 29.49 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.605 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.492 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 0.5 OUTLIER -87.78 -21.55 25.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.241 -0.912 . . . . 0.0 109.525 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 87' ' ' PHE . . . . . 0.464 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.9 t80 . . . . . 0 N--CA 1.489 1.519 0 O-C-N 121.286 -0.884 . . . . 0.0 109.519 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.475 ' N ' ' HB2' ' A' ' 4' ' ' GLU . 1.1 t . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.753 ' HB2' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -47.65 -49.2 28.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.0 109.534 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.867 HD11 HG21 ' B' ' 13' ' ' VAL . 2.3 mp -76.49 -23.38 53.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.475 ' HB2' ' N ' ' A' ' 1' ' ' SER . 2.0 mt-10 -62.42 -63.91 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.346 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -38.59 90.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.311 -0.868 . . . . 0.0 109.297 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -70.63 -15.55 62.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.298 -0.876 . . . . 0.0 109.428 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.06 -46.49 16.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.316 -0.865 . . . . 0.0 109.385 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.11 -41.93 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.457 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HB1' ' OE1' ' B' ' 2' ' ' GLU . . . -67.7 -54.18 21.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.922 . . . . 0.0 109.42 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.532 ' HG ' ' CD1' ' B' ' 3' ' ' LEU . 0.2 OUTLIER -47.68 -46.37 29.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.2 -0.937 . . . . 0.0 109.397 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 45.5 mt -59.3 -38.95 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.396 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 91.3 m-20 -64.63 -24.46 67.59 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.262 -0.899 . . . . 0.0 109.532 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.918 HG21 HD21 ' B' ' 3' ' ' LEU . 2.7 t -81.01 -29.87 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 10.9 t80 -69.63 -47.77 62.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.941 -1.099 . . . . 0.0 109.507 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -78.99 -33.43 45.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.558 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 39.1 tt0 -68.82 -64.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.907 . . . . 0.0 109.468 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.69 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 26.0 m-85 -55.4 -48.23 74.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.5 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 33.7 t -69.64 -19.03 63.62 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.289 -0.882 . . . . 0.0 109.47 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.38 16.09 59.77 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 22.4 mmm180 -81.46 -46.65 14.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.492 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 1.0 OUTLIER -74.2 169.72 17.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.277 -0.889 . . . . 0.0 109.498 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.54 -52.87 7.28 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.0 -162.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -1.169 . . . . 0.0 109.421 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 179.5 80.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.297 -0.877 . . . . 0.0 109.449 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -152.82 -39.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.527 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -144.13 168.11 20.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.587 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.899 HD22 ' HB3' ' A' ' 31' ' ' GLU . 56.6 mt -86.17 152.08 23.12 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.339 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -119.16 69.45 0.82 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.777 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HD3' ' N ' ' A' ' 30' ' ' SER . 1.6 tmtt? 64.48 -81.6 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.518 -0.739 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.53 ' N ' ' HD3' ' A' ' 29' ' ' LYS . 4.3 m -48.28 -32.4 7.25 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.87 -1.144 . . . . 0.0 110.187 -179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.899 ' HB3' HD22 ' A' ' 27' ' ' LEU . 7.4 mm-40 -64.5 -43.01 95.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.962 -1.086 . . . . 0.0 108.568 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.651 HD22 HD13 ' A' ' 27' ' ' LEU . 3.2 mm? -55.93 -61.45 2.37 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.977 ' HG3' HG11 ' A' ' 53' ' ' VAL . 2.3 ttmt -52.15 -36.58 51.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.44 -0.788 . . . . 0.0 109.829 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -38.44 79.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 0.0 109.534 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.758 HD23 ' CE2' ' A' ' 76' ' ' PHE . 13.3 tp -75.14 -38.68 60.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.338 -0.851 . . . . 0.0 109.995 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.911 HG23 HD22 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -75.75 -14.16 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 109.744 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.474 ' HA ' ' OG ' ' A' ' 41' ' ' SER . 3.0 m120 -93.82 -57.02 2.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.973 -1.08 . . . . 0.0 109.756 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -73.92 -10.94 60.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.236 -0.915 . . . . 0.0 109.723 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.802 ' C ' HD12 ' A' ' 40' ' ' LEU . 2.5 mm-40 -121.01 -33.31 3.76 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.065 -1.022 . . . . 0.0 109.968 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.911 HD22 HG23 ' A' ' 36' ' ' ILE . 7.4 mp -117.9 66.0 0.75 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.047 -1.033 . . . . 0.0 109.606 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.474 ' OG ' ' HA ' ' A' ' 37' ' ' ASN . 7.7 m . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.296 -0.878 . . . . 0.0 109.374 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 1.053 HD12 HG23 ' A' ' 53' ' ' VAL . 24.3 mm . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.336 0.588 . . . . 0.0 109.434 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.7 pttt 39.7 25.22 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.666 -0.646 . . . . 0.0 111.185 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 mt-10 161.13 34.07 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.998 -1.063 . . . . 0.0 110.244 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.747 ' N ' HG22 ' A' ' 47' ' ' ILE . 32.0 mt-30 40.33 37.11 0.39 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.278 -0.889 . . . . 0.0 109.748 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -68.45 -70.51 0.26 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.157 -0.964 . . . . 0.0 109.627 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 1.3 t -80.86 -9.78 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.058 -1.026 . . . . 0.0 109.158 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.053 HG23 HD12 ' A' ' 47' ' ' ILE . 55.9 t -80.83 -45.91 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.19 -0.944 . . . . 0.0 108.939 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.14 -28.3 60.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.457 -0.777 . . . . 0.0 108.959 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -56.33 4.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.39 -0.819 . . . . 0.0 109.257 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 1.1 HG11 HG22 ' A' ' 80' ' ' VAL . 17.1 m -57.08 -48.15 82.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.054 -1.029 . . . . 0.0 109.542 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.608 ' N ' HG23 ' A' ' 56' ' ' VAL . 19.1 tpp -42.89 -45.14 4.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.205 -0.934 . . . . 0.0 109.68 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.77 -49.25 73.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.18 -0.95 . . . . 0.0 109.489 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.583 HG21 ' SD ' ' A' ' 79' ' ' MET . 4.5 t -77.53 -8.97 58.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.288 -0.883 . . . . 0.0 109.913 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 32' ' ' LEU . 13.2 mt -97.27 11.58 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 109.397 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -77.97 113.88 16.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.245 -0.909 . . . . 0.0 109.511 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.422 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 39.1 t30 -60.28 -50.37 73.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 109.477 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -150.35 16.5 0.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.176 -0.953 . . . . 0.0 109.589 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.08 75.18 1.29 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -176.98 30.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -1.163 . . . . 0.0 108.406 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 49.31 22.43 3.52 Favored Glycine 0 N--CA 1.482 1.758 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.3 mt-10 -106.76 96.57 6.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -1.141 . . . . 0.0 109.436 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.516 ' SG ' HD21 ' A' ' 32' ' ' LEU . 56.3 m -69.97 162.25 28.46 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.218 -0.926 . . . . 0.0 109.835 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.49 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 20.9 t70 -128.18 170.95 12.4 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -52.55 -51.22 60.74 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.093 -1.004 . . . . 0.0 110.203 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 0.5 OUTLIER -54.82 -30.6 57.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.28 -0.887 . . . . 0.0 109.103 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' CD2' ' A' ' 60' ' ' LEU . 3.8 mt-10 -82.52 -24.87 33.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' B' ' 3' ' ' LEU . 1.2 t80 -63.93 -57.55 9.44 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.121 -0.987 . . . . 0.0 108.642 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.909 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.1 OUTLIER -64.15 -48.88 74.33 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.343 -0.848 . . . . 0.0 108.763 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -55.52 -25.16 35.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.878 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -67.29 -69.41 0.31 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.438 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.878 HG23 ' CE2' ' A' ' 76' ' ' PHE . 40.0 t -53.45 -21.11 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.408 -0.807 . . . . 0.0 109.057 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.866 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.05 -50.29 64.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.332 -0.855 . . . . 0.0 109.484 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.657 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 44.8 mtp -73.6 -63.56 1.18 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.62 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 1.1 HG22 HG11 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -47.32 -22.83 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.842 0 O-C-N 120.565 -1.335 . . . . 0.0 109.41 -179.059 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.3 m -80.32 -68.83 0.64 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.03 -1.044 . . . . 0.0 109.123 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.8 t -74.32 -49.46 22.87 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.98 -1.075 . . . . 0.0 109.088 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.19 -31.08 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.421 0.629 . . . . 0.0 109.607 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.488 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.9 t -81.03 -58.36 3.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.0 109.288 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -45.05 -60.99 1.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.279 -0.888 . . . . 0.0 109.482 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -53.42 -47.53 69.53 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.39 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 58.8 t80 . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.516 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.661 ' HG3' HG23 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -70.96 -70.08 0.33 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.92 . . . . 0.0 109.485 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.918 HD21 HG21 ' A' ' 13' ' ' VAL . 3.3 mm? -75.12 -17.59 60.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.26 -0.9 . . . . 0.0 109.393 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' B' ' 7' ' ' MET . 22.5 tt0 -73.36 -61.72 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.418 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.612 ' O ' HG12 ' B' ' 8' ' ' VAL . 7.4 ttmt -61.0 -51.19 70.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -58.86 -15.76 14.09 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.505 ' SD ' ' CD1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -82.29 -53.86 5.7 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.612 HG12 ' O ' ' B' ' 5' ' ' LYS . 9.4 p -55.7 -28.55 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.241 -0.912 . . . . 0.0 109.545 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.753 ' HB1' ' HB2' ' A' ' 2' ' ' GLU . . . -78.47 -62.91 1.53 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.607 ' O ' HG12 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -50.71 -21.71 1.74 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.931 . . . . 0.0 109.557 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 73.8 mt -77.02 -62.43 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -48.17 -23.39 0.84 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.231 -0.918 . . . . 0.0 109.535 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.867 HG21 HD11 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -81.61 -40.38 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.513 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.561 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 28.1 t80 -57.05 -50.5 72.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.12 -0.987 . . . . 0.0 109.254 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.475 ' HA ' ' HB2' ' B' ' 18' ' ' SER . 0.6 OUTLIER -67.85 -35.92 79.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.412 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -51.56 -57.45 9.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.484 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.935 ' CD2' HD21 ' B' ' 35' ' ' LEU . 78.8 m-85 -64.82 -28.05 69.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.225 -0.922 . . . . 0.0 109.482 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 0.6 OUTLIER -65.72 -20.94 66.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.925 . . . . 0.0 109.521 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.51 16.99 59.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 29.5 mmt180 -90.08 -57.48 2.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.256 -1.143 . . . . 0.0 109.432 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 165.73 23.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.297 -0.877 . . . . 0.0 109.409 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.11 -122.59 5.86 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' HB2' ' HE2' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -94.03 -156.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.292 -1.122 . . . . 0.0 109.517 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' B' ' 25' ' ' HIS . 13.0 mtmm -132.46 28.09 4.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 31.0 m-70 -162.46 26.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.268 -0.895 . . . . 0.0 109.47 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.06 143.59 2.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.283 -0.885 . . . . 0.0 109.445 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.708 HD12 ' CB ' ' B' ' 31' ' ' GLU . 0.9 OUTLIER -93.24 167.27 11.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.957 . . . . 0.0 109.555 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.1 OUTLIER -135.7 80.58 1.84 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.388 -0.82 . . . . 0.0 109.369 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 64.0 -84.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.74 . . . . 0.0 110.32 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 29' ' ' LYS . 2.5 m -41.71 -57.51 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.136 -0.978 . . . . 0.0 110.482 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.708 ' CB ' HD12 ' B' ' 27' ' ' LEU . 64.7 mm-40 -61.15 -33.07 72.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.897 -1.127 . . . . 0.0 109.597 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.655 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 52.4 mt -56.0 -68.87 0.17 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.386 -0.821 . . . . 0.0 108.847 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.559 ' CD ' HG11 ' B' ' 53' ' ' VAL . 2.8 mttt -44.15 -33.88 1.66 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.32 -0.863 . . . . 0.0 109.073 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -58.73 -66.57 0.48 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.478 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.935 HD21 ' CD2' ' B' ' 17' ' ' TYR . 4.2 mm? -42.7 -40.65 2.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.88 . . . . 0.0 109.737 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.827 HD11 ' CZ ' ' B' ' 76' ' ' PHE . 2.8 mm -59.92 -50.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.227 -0.92 . . . . 0.0 109.687 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.14 6.29 14.25 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.235 -0.915 . . . . 0.0 109.612 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -127.44 7.03 6.35 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.184 -0.947 . . . . 0.0 109.714 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.869 ' CD ' HG22 ' B' ' 77' ' ' VAL . 5.8 pt-20 -142.87 -33.74 0.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.177 -0.952 . . . . 0.0 110.155 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.757 HD23 ' HA ' ' B' ' 36' ' ' ILE . 3.8 mm? -52.55 -69.07 0.12 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.016 -1.052 . . . . 0.0 109.403 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.9 p . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.397 -0.815 . . . . 0.0 109.389 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.727 HG21 ' HA ' ' B' ' 50' ' ' GLN . 14.5 mm . . . . . 0 N--CA 1.497 1.894 0 CA-C-O 120.694 0.283 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 84.58 -36.28 0.06 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.392 -0.818 . . . . 0.0 109.82 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.539 ' N ' ' HG2' ' B' ' 48' ' ' LYS . 5.0 tt0 178.46 33.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.076 -1.015 . . . . 0.0 109.48 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.727 ' HA ' HG21 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 50.14 51.32 16.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.13 -57.28 2.91 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.635 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.838 HG11 ' HA ' ' B' ' 80' ' ' VAL . 40.1 t -86.97 -13.58 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.655 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.679 HG21 HG13 ' B' ' 47' ' ' ILE . 37.7 t -77.47 -15.62 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 120.902 -1.124 . . . . 0.0 109.339 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -48.84 6.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.327 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -72.31 -42.04 65.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.874 . . . . 0.0 109.383 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.978 HG21 ' CE1' ' B' ' 76' ' ' PHE . 5.4 p -56.4 -46.48 81.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.203 -0.936 . . . . 0.0 109.386 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.655 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 8.1 tpp -42.79 -47.1 5.43 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.416 -0.802 . . . . 0.0 109.169 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.447 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.9 OUTLIER -57.14 -45.11 83.81 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.749 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.712 HG22 ' O ' ' B' ' 56' ' ' VAL . 3.9 t -75.14 -12.24 60.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.0 110.077 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.605 HD21 ' CG ' ' B' ' 76' ' ' PHE . 34.1 mt -91.12 -9.03 47.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.34 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 17.1 p-10 -62.6 113.39 2.96 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.276 -0.89 . . . . 0.0 109.576 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.516 ' CA ' ' OE2' ' B' ' 72' ' ' GLU . 9.1 p-10 -81.17 -45.89 15.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.266 -0.896 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.43 ' N ' ' CG ' ' B' ' 62' ' ' ASN . 0.6 OUTLIER -131.77 1.0 3.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 75.51 1.2 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -175.3 29.83 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -1.156 . . . . 0.0 108.385 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.3 26.26 6.6 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.454 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 87.0 mt-10 -105.76 111.95 24.83 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -1.136 . . . . 0.0 109.437 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 16.2 t -69.64 159.02 34.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.493 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.3 OUTLIER -130.03 172.54 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.424 -0.797 . . . . 0.0 109.249 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.467 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.2 OUTLIER -58.33 -53.56 56.88 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.377 -0.827 . . . . 0.0 110.466 -179.667 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.714 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.87 -40.55 89.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.28 -0.887 . . . . 0.0 108.611 -179.836 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.516 ' OE2' ' CA ' ' B' ' 62' ' ' ASN . 0.3 OUTLIER -76.48 -12.07 59.98 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.442 -0.786 . . . . 0.0 109.083 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.561 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 8.5 t80 -73.26 -57.99 3.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.866 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.51 -45.72 90.91 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.102 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -60.02 -33.18 71.65 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.353 -0.842 . . . . 0.0 108.784 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.978 ' CE1' HG21 ' B' ' 56' ' ' VAL . 1.0 OUTLIER -57.26 -70.03 0.14 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.014 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.869 HG22 ' CD ' ' B' ' 39' ' ' GLU . 6.7 t -50.22 -32.34 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.468 -0.77 . . . . 0.0 109.31 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.909 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -58.98 -45.55 90.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 109.867 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.695 ' HE3' HG21 ' B' ' 59' ' ' THR . 2.7 mpp? -76.46 -68.4 0.6 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.197 -0.94 . . . . 0.0 109.825 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.838 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.29 -24.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.452 -1.405 . . . . 0.0 109.441 -179.239 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.504 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 8.5 m -77.7 -68.1 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.051 -1.031 . . . . 0.0 108.916 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -79.08 -49.65 12.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 108.798 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.69 -37.43 0.22 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.742 -0.599 . . . . 0.0 109.789 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 43.3 t -72.96 -48.31 37.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.3 -0.875 . . . . 0.0 109.47 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.66 -10.06 32.86 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.243 -0.911 . . . . 0.0 109.473 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -38.52 69.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 0.0 109.411 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.305 -0.872 . . . . 0.0 109.442 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 29.6 t . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.371 0.605 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.32 -70.67 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 109.913 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.92 HD22 ' OE2' ' B' ' 39' ' ' GLU . 6.0 mt -78.51 -33.13 48.3 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.118 -0.989 . . . . 0.0 110.02 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 11.5 tt0 -57.77 -59.97 4.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.086 -1.008 . . . . 0.0 109.246 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.17 -53.21 59.86 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.347 -0.845 . . . . 0.0 109.469 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -61.24 -12.84 14.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.295 -0.878 . . . . 0.0 109.671 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.781 ' O ' HD12 ' A' ' 11' ' ' ILE . 4.9 ttp -80.29 -60.43 2.33 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.172 -0.955 . . . . 0.0 109.435 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 8' ' ' VAL . 4.2 t -55.01 -27.89 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.482 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -77.82 -64.31 1.18 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.63 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.52 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.2 OUTLIER -43.3 -53.4 5.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 0.0 109.754 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.781 HD12 ' O ' ' A' ' 7' ' ' MET . 2.1 mp -59.24 -45.88 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.275 -0.891 . . . . 0.0 109.583 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 0.5 OUTLIER -55.74 -23.48 29.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.195 -0.941 . . . . 0.0 109.413 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.868 ' CG1' HD21 ' A' ' 35' ' ' LEU . 1.2 t -89.13 -27.09 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.259 -0.901 . . . . 0.0 109.231 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.583 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 10.3 t80 -64.67 -42.4 95.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.012 -1.055 . . . . 0.0 109.057 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.426 ' O ' ' N ' ' A' ' 19' ' ' GLY . 65.0 m170 -82.4 -44.37 16.18 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.325 -0.859 . . . . 0.0 109.518 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -52.8 -59.44 4.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.512 ' CD1' HG13 ' A' ' 13' ' ' VAL . 34.6 m-85 -61.85 -45.76 92.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.891 . . . . 0.0 109.616 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.758 ' OG ' HD12 ' A' ' 27' ' ' LEU . 48.2 m -72.26 -3.08 21.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.772 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 15' ' ' HIS . . . -75.1 -9.16 83.95 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HD3' ' OE2' ' A' ' 31' ' ' GLU . 16.9 mtt85 -87.93 -34.68 18.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.305 -1.115 . . . . 0.0 109.462 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 8.9 tt0 -69.94 154.4 42.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.299 -0.876 . . . . 0.0 109.381 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -43.49 -26.94 0.73 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' OD2' ' HD3' ' A' ' 26' ' ' LYS . 37.1 t70 -112.34 135.62 52.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 18' ' ' SER . 6.4 ptmt -91.99 70.91 5.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.287 -0.883 . . . . 0.0 109.571 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.576 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.5 OUTLIER -170.2 -34.79 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -118.75 151.05 38.74 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.975 . . . . 0.0 109.785 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.863 HD22 HD23 ' A' ' 32' ' ' LEU . 7.2 mp -89.77 165.92 13.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.232 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 10.4 pttp -122.47 69.94 0.98 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.203 -0.935 . . . . 0.0 109.634 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' A' ' 30' ' ' SER . 0.3 OUTLIER 62.18 -84.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.453 -0.779 . . . . 0.0 110.339 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.496 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 7.9 t -46.1 -42.22 13.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.169 -0.957 . . . . 0.0 110.445 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.789 ' C ' HD23 ' A' ' 27' ' ' LEU . 67.5 mm-40 -56.77 -42.46 79.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.906 -1.121 . . . . 0.0 109.146 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.94 HD13 HD12 ' A' ' 60' ' ' LEU . 33.1 mt -60.15 -65.53 0.67 Allowed 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.528 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 2.4 ttpp -40.8 -29.61 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.369 -0.832 . . . . 0.0 109.52 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -66.81 -58.1 5.72 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.322 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.868 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.8 -29.08 17.66 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.36 -0.837 . . . . 0.0 109.569 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.738 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.0 mp -74.46 -40.02 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.148 -0.97 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.528 ' ND2' ' HG3' ' A' ' 33' ' ' LYS . 73.2 m-80 -90.19 6.1 44.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 109.689 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.71 -37.58 5.63 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 109.414 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.521 ' OE1' HD22 ' B' ' 3' ' ' LEU . 1.9 pt-20 -111.76 -25.82 9.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.315 -0.866 . . . . 0.0 109.327 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.52 ' CD1' ' HB ' ' A' ' 80' ' ' VAL . 89.2 mt -108.28 69.44 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.904 HD12 HG21 ' A' ' 53' ' ' VAL . 5.5 mm . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 85.53 -32.15 0.05 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.814 -0.554 . . . . 0.0 109.767 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 3.2 mt-10 162.52 64.7 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.193 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.2 OUTLIER 33.45 48.35 0.18 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.247 0.546 . . . . 0.0 110.045 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.407 ' OE1' ' C ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -90.05 -62.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.347 -0.846 . . . . 0.0 109.772 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.933 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.6 t -88.35 -14.33 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.072 -1.017 . . . . 0.0 109.92 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.904 HG21 HD12 ' A' ' 47' ' ' ILE . 27.4 t -84.01 -28.43 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.832 -1.167 . . . . 0.0 108.68 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.69 -33.23 20.11 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.27 -0.894 . . . . 0.0 108.773 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -51.43 7.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.82 . . . . 0.0 108.974 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.905 HG22 HD21 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -60.62 -41.87 89.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 O-C-N 121.159 -0.963 . . . . 0.0 108.896 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.77 ' SD ' HD12 ' A' ' 32' ' ' LEU . 7.1 tpt -42.01 -50.02 4.64 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.595 -0.69 . . . . 0.0 109.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -43.85 88.28 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.233 -0.917 . . . . 0.0 108.942 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.526 HG21 ' SD ' ' A' ' 79' ' ' MET . 15.8 m -62.23 -23.8 66.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.359 -0.838 . . . . 0.0 109.652 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.94 HD12 HD13 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -85.66 -27.43 25.38 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.13 -0.981 . . . . 0.0 109.275 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.613 ' OD1' ' HE2' ' A' ' 57' ' ' MET . 82.2 m-20 -63.41 114.08 3.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.224 -0.922 . . . . 0.0 109.51 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.4 ' HA ' ' OE2' ' A' ' 72' ' ' GLU . 5.5 t-20 -47.95 -43.08 28.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 109.425 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.99 25.82 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.441 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.16 88.84 2.04 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.11 -34.43 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.2 -1.177 . . . . 0.0 108.622 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 27' ' ' LEU . . . 110.1 -19.02 27.96 Favored Glycine 0 N--CA 1.485 1.947 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.415 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 26.8 mt-10 -73.11 97.4 2.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 109.541 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 12.9 t -69.79 154.28 42.18 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.198 -0.939 . . . . 0.0 109.619 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.482 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -113.32 171.33 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.806 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.522 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.1 OUTLIER -61.39 -50.13 74.11 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.229 -0.919 . . . . 0.0 110.091 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.548 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 4.4 mp0 -54.83 -40.05 69.2 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.316 -0.865 . . . . 0.0 109.145 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 60' ' ' LEU . 2.4 mt-10 -79.69 -17.82 52.74 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.306 -0.871 . . . . 0.0 109.663 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.743 ' CZ ' HD21 ' B' ' 3' ' ' LEU . 22.1 t80 -69.56 -54.72 12.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.07 -1.019 . . . . 0.0 108.84 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.693 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 1.6 ttm -64.42 -44.4 91.35 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.278 -0.889 . . . . 0.0 108.787 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' ' CE ' ' A' ' 79' ' ' MET . . . -64.04 -25.11 67.97 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.303 -0.873 . . . . 0.0 108.817 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.09 -65.72 0.64 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 HD23 ' B' ' 3' ' ' LEU . 39.9 t -61.31 -22.14 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.885 . . . . 0.0 108.95 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.797 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.42 -40.97 89.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.365 -0.834 . . . . 0.0 109.341 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.651 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 49.3 mtm -78.02 -66.26 0.87 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.281 -0.887 . . . . 0.0 109.42 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.933 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.48 -22.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 O-C-N 120.474 -1.391 . . . . 0.0 109.462 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.495 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 6.2 m -80.67 -68.0 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.002 -1.061 . . . . 0.0 109.096 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.557 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.4 t -75.94 -49.33 18.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.0 109.089 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.52 -40.89 0.27 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.707 -0.621 . . . . 0.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.4 t -77.4 -42.57 35.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -0.906 . . . . 0.0 109.523 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 82' ' ' THR . 1.4 t60 -64.44 -11.0 28.85 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.219 -0.926 . . . . 0.0 109.522 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -39.04 21.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.286 -0.884 . . . . 0.0 109.504 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.0 t80 . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.256 -0.903 . . . . 0.0 109.502 -179.985 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.526 ' HB2' HG21 ' A' ' 13' ' ' VAL . 2.1 mp0 -72.74 -69.26 0.42 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.423 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.971 HD23 HG21 ' A' ' 77' ' ' VAL . 6.2 mp -65.39 -11.16 39.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.905 . . . . 0.0 109.468 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.987 ' O ' HG23 ' B' ' 8' ' ' VAL . 30.9 tt0 -73.83 -62.58 1.45 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.219 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.47 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -65.39 -36.55 84.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.268 -0.895 . . . . 0.0 109.135 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.27 -66.46 0.54 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.308 -0.87 . . . . 0.0 109.433 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.483 ' O ' HG12 ' B' ' 11' ' ' ILE . 0.4 OUTLIER -45.3 -30.81 1.36 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.309 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.987 HG23 ' O ' ' B' ' 4' ' ' GLU . 79.6 t -60.64 -55.61 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.122 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -44.92 87.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.177 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.741 ' CD1' HD23 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -58.76 -26.44 64.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.312 -0.868 . . . . 0.0 109.34 179.824 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.927 HD13 ' CZ ' ' B' ' 70' ' ' PHE . 9.0 mm -70.08 -48.29 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.267 -0.895 . . . . 0.0 109.108 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.8 OUTLIER -65.43 -19.03 65.77 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.49 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.559 HG11 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -88.22 -30.85 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.227 -0.92 . . . . 0.0 109.338 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 18.8 t80 -67.91 -46.07 72.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.02 -1.05 . . . . 0.0 109.214 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 53.6 m170 -79.53 -34.24 41.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.242 -0.911 . . . . 0.0 109.64 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -62.7 -61.75 2.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 109.455 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.961 ' CG ' HD21 ' B' ' 35' ' ' LEU . 35.9 m-85 -58.19 -44.58 88.14 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.233 -0.917 . . . . 0.0 109.614 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.473 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 83.4 p -67.0 -18.88 65.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.565 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.85 13.73 66.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.529 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.07 -38.24 13.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -1.158 . . . . 0.0 109.435 179.977 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -166.05 140.36 4.46 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 109.468 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 23' ' ' ASP . . . 84.28 -149.39 24.95 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.452 ' O ' ' O ' ' B' ' 18' ' ' SER . 4.0 p30 -54.75 -169.55 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.8 ptpt -134.12 11.85 3.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.407 ' C ' ' HD3' ' B' ' 26' ' ' LYS . 18.2 m80 -138.27 7.15 2.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 109.595 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -143.07 170.14 16.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.701 HD23 ' C ' ' B' ' 31' ' ' GLU . 4.2 mp -121.96 139.26 53.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.165 -0.959 . . . . 0.0 110.3 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.523 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 14.7 tttm -86.18 156.95 20.11 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' B' ' 32' ' ' LEU . 11.8 mttt -37.46 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.062 -1.023 . . . . 0.0 109.987 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.521 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.5 OUTLIER -79.0 -45.95 19.19 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.701 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.2 OUTLIER -58.47 -40.26 82.22 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 120.808 -1.182 . . . . 0.0 108.776 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.919 HD21 ' SG ' ' B' ' 68' ' ' CYS . 2.6 mt -59.12 -63.4 1.32 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.746 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -39.97 -44.21 1.67 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.514 -0.741 . . . . 0.0 109.871 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.46 -61.04 2.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.961 HD21 ' CG ' ' B' ' 17' ' ' TYR . 2.4 mm? -49.29 -58.56 4.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -0.864 . . . . 0.0 109.804 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.982 HD12 HG22 ' B' ' 53' ' ' VAL . 0.7 OUTLIER -43.23 -35.34 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.31 -0.869 . . . . 0.0 109.739 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -73.67 -54.8 7.28 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 110.142 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' B' ' 38' ' ' ASN . 1.5 m120 -96.29 27.59 3.66 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.171 -0.956 . . . . 0.0 109.579 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.92 ' OE2' HD22 ' A' ' 3' ' ' LEU . 21.5 tt0 -127.79 -37.79 1.92 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.236 -0.915 . . . . 0.0 109.321 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.3 mm? -73.02 -56.26 5.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.313 -0.867 . . . . 0.0 109.285 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 5.4 t . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.499 -0.75 . . . . 0.0 108.978 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.805 HD12 HG23 ' B' ' 53' ' ' VAL . 23.3 mm . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.26 0.552 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.481 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 42.98 26.2 0.07 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.08 -1.012 . . . . 0.0 109.577 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.481 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.4 tt0 75.02 87.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.115 -0.991 . . . . 0.0 109.83 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.478 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 42.39 50.66 4.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.322 -0.861 . . . . 0.0 109.839 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.491 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.5 tp10 -91.2 -70.57 0.68 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.174 -0.954 . . . . 0.0 109.705 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 1.023 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.0 t -91.51 -15.04 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.182 -0.949 . . . . 0.0 109.38 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.982 HG22 HD12 ' B' ' 36' ' ' ILE . 62.3 t -84.28 -30.01 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 120.966 -1.084 . . . . 0.0 108.594 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 10.1 t0 -90.18 -29.08 18.47 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.308 -0.87 . . . . 0.0 108.873 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 10.5 mtmt -85.27 -47.93 9.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.392 -0.817 . . . . 0.0 109.23 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.918 HG22 HD21 ' B' ' 60' ' ' LEU . 0.6 OUTLIER -65.66 -40.67 88.61 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.124 -0.985 . . . . 0.0 109.006 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.84 ' SD ' HD13 ' B' ' 32' ' ' LEU . 8.0 tpt -39.9 -52.53 2.39 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.763 -0.586 . . . . 0.0 109.723 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.73 -42.27 96.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.196 -0.94 . . . . 0.0 108.863 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.409 ' N ' ' O ' ' B' ' 56' ' ' VAL . 96.6 m -62.22 -20.51 64.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.363 -0.836 . . . . 0.0 109.799 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.918 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -85.33 -73.62 0.43 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.041 -1.037 . . . . 0.0 109.189 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.46 ' HA ' ' OE1' ' B' ' 72' ' ' GLU . 9.8 t70 -84.64 93.12 8.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.28 -0.888 . . . . 0.0 109.547 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.29 10.74 40.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.907 . . . . 0.0 109.369 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -92.43 -41.84 10.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 109.558 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 90.05 2.1 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -172.87 -37.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.293 -1.122 . . . . 0.0 108.463 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 32.88 3.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 5.2 mt-10 -144.9 113.11 6.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.255 -1.144 . . . . 0.0 109.361 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.919 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.86 151.18 46.0 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.202 -0.936 . . . . 0.0 109.904 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.497 ' HB3' ' HG3' ' B' ' 72' ' ' GLU . 4.5 t70 -112.46 171.29 7.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -0.856 . . . . 0.0 108.724 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.927 ' CZ ' HD13 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -54.36 -53.0 59.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.225 -0.922 . . . . 0.0 110.491 -179.466 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.425 ' OE1' ' OD2' ' B' ' 69' ' ' ASP . 0.0 OUTLIER -56.61 -26.65 56.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.151 -0.968 . . . . 0.0 109.269 -179.716 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' B' ' 69' ' ' ASP . 6.5 mt-10 -85.58 -22.66 27.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 109.831 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.539 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 50.8 t80 -74.28 -40.41 62.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.09 -1.006 . . . . 0.0 108.943 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.797 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -75.6 -41.12 55.33 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.48 -0.762 . . . . 0.0 109.196 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.452 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -65.21 -30.95 71.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.15 -0.969 . . . . 0.0 108.861 179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.691 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -66.08 -63.37 1.1 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.449 -0.782 . . . . 0.0 108.944 179.691 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.564 ' N ' ' CG ' ' B' ' 76' ' ' PHE . 52.2 t -57.83 -26.78 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.189 -0.944 . . . . 0.0 109.351 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.693 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.09 -34.49 77.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.345 -0.847 . . . . 0.0 109.472 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.652 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.3 OUTLIER -82.86 -69.4 0.63 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 109.659 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 1.023 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.88 -23.78 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.549 -1.345 . . . . 0.0 109.334 -179.413 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 12.0 m -78.42 -67.74 0.71 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.561 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -78.22 -49.54 13.57 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.136 -0.977 . . . . 0.0 108.874 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.652 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.83 -36.38 0.11 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.769 -0.582 . . . . 0.0 109.82 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.3 t -90.03 -36.94 14.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.202 -0.936 . . . . 0.0 109.438 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' B' ' 82' ' ' THR . 60.3 t60 -62.33 -12.95 23.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.95 -31.3 23.66 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.2 -0.938 . . . . 0.0 109.406 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.437 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 16.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.518 ' HG2' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -74.31 -77.54 0.11 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.457 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.713 HD13 ' HG2' ' B' ' 39' ' ' GLU . 7.3 mp -66.91 -15.53 63.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.447 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.783 ' O ' HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -73.65 -63.02 1.29 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.378 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.449 ' O ' ' HD2' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -63.08 -34.18 77.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.249 -0.907 . . . . 0.0 109.356 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.518 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -66.44 -66.92 0.49 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 0.0 109.549 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.618 ' O ' HD12 ' A' ' 11' ' ' ILE . 6.8 ptm -43.93 -31.78 0.96 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 4' ' ' GLU . 71.5 t -62.4 -55.65 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.513 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.862 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -63.42 -57.72 9.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.504 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.148 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -44.04 -37.96 3.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 109.372 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.618 HD12 ' O ' ' A' ' 7' ' ' MET . 32.9 mt -64.64 -45.8 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.937 . . . . 0.0 109.36 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -58.27 -23.68 56.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.282 -0.886 . . . . 0.0 109.302 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -83.47 -38.6 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.264 -0.898 . . . . 0.0 109.398 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.0 t80 -59.56 -51.96 67.58 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 120.92 -1.112 . . . . 0.0 109.425 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -55.16 14.88 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.562 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -46.09 -69.47 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.221 -0.924 . . . . 0.0 109.605 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.58 ' CE1' ' HG ' ' A' ' 35' ' ' LEU . 41.3 m-85 -50.2 -27.67 6.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.248 -0.908 . . . . 0.0 109.561 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.484 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -62.52 -44.9 95.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 109.427 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -55.27 -18.52 14.05 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 27.8 mmm180 -68.14 -41.87 81.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.308 -1.113 . . . . 0.0 109.419 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.568 ' CG ' ' CD ' ' A' ' 28' ' ' LYS . 2.7 tm-20 -82.23 161.24 22.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.318 -0.864 . . . . 0.0 109.433 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -45.52 -51.04 10.11 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -94.97 167.33 11.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.232 -1.158 . . . . 0.0 109.402 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.526 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 11.4 mttt -118.13 86.96 2.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.294 -0.879 . . . . 0.0 109.522 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.9 t-80 -170.08 -35.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.911 . . . . 0.0 109.624 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 5.7 mtmt -140.05 170.11 16.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 ' HB3' ' A' ' 31' ' ' GLU . 82.5 mt -107.05 170.09 8.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.284 -0.885 . . . . 0.0 109.497 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.568 ' CD ' ' CG ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -128.97 73.59 1.52 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.141 -0.974 . . . . 0.0 109.917 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.853 ' HA ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttmt 62.35 -84.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.442 -0.786 . . . . 0.0 110.696 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.467 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.8 OUTLIER -43.81 -50.53 7.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.115 -0.991 . . . . 0.0 110.567 -179.058 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.772 ' HB3' HD22 ' A' ' 27' ' ' LEU . 6.1 mm-40 -52.69 -40.89 63.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.972 -1.08 . . . . 0.0 109.513 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 29' ' ' LYS . 14.2 mt -58.92 -65.89 0.59 Allowed 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.623 -0.673 . . . . 0.0 109.631 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.52 ' CA ' HG13 ' A' ' 36' ' ' ILE . 7.1 ttpp -38.47 -37.64 0.32 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.578 -0.701 . . . . 0.0 110.016 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.448 ' O ' ' OD1' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -65.9 -50.29 65.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -0.939 . . . . 0.0 109.474 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 13' ' ' VAL . 1.3 mt -60.93 -21.53 63.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 0.0 109.783 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.909 ' CD1' HG13 ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.25 -57.97 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.166 -0.959 . . . . 0.0 109.575 -179.75 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.424 ' OD1' HD12 ' A' ' 47' ' ' ILE . 70.3 m-80 -70.1 -5.18 25.1 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.19 -0.944 . . . . 0.0 109.67 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 34' ' ' GLU . 6.5 m120 -114.39 -8.75 12.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.186 -0.946 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.768 ' OE2' HG13 ' A' ' 77' ' ' VAL . 1.8 tm-20 -94.25 -46.91 6.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.175 -0.953 . . . . 0.0 109.584 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.669 HD22 ' N ' ' A' ' 40' ' ' LEU . 2.9 mm? -72.9 -52.35 15.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.215 -0.928 . . . . 0.0 109.555 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.428 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.155 -0.965 . . . . 0.0 109.656 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.6 ' CG2' ' CG2' ' A' ' 53' ' ' VAL . 6.1 mt . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -42.5 -34.79 0.9 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.355 -0.841 . . . . 0.0 109.444 179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' A' ' 50' ' ' GLN . 14.1 pt-20 178.37 -31.72 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.449 -0.782 . . . . 0.0 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 8.1 pt20 -159.72 29.98 0.19 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.266 -0.896 . . . . 0.0 109.759 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.79 -70.86 0.16 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.033 -1.042 . . . . 0.0 108.802 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.836 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -90.96 -12.72 9.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.631 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.909 HG13 ' CD1' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -76.91 -30.27 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 22.6 t70 -76.24 -47.18 24.85 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.278 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -50.54 63.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.296 -0.878 . . . . 0.0 109.394 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 1.013 HG11 HG22 ' A' ' 80' ' ' VAL . 24.0 m -57.78 -47.31 86.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.114 -0.991 . . . . 0.0 109.58 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.602 ' N ' HG23 ' A' ' 56' ' ' VAL . 9.9 tpt -38.21 -49.55 1.37 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.576 -0.702 . . . . 0.0 110.349 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -60.02 -46.1 90.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.12 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 59' ' ' THR . 28.6 m -73.18 -8.76 57.21 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.443 -0.786 . . . . 0.0 109.856 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.656 ' N ' HD23 ' A' ' 60' ' ' LEU . 1.9 mt -84.78 -27.68 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.166 -0.959 . . . . 0.0 109.324 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -43.73 110.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.537 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.521 ' CB ' ' OD1' ' A' ' 69' ' ' ASP . 33.2 t30 -60.1 -52.05 67.0 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.3 -0.875 . . . . 0.0 109.42 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -152.57 18.12 0.62 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.224 -0.922 . . . . 0.0 109.519 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.79 88.53 1.77 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.28 -36.66 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.301 -1.117 . . . . 0.0 108.525 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.2 -1.23 31.26 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -99.83 121.7 41.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.213 -1.169 . . . . 0.0 109.483 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.647 ' CB ' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -69.51 131.28 44.47 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.521 ' OD1' ' CB ' ' A' ' 62' ' ' ASN . 2.2 m-20 -110.27 170.66 7.93 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.579 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 1.2 t80 -52.96 -50.63 63.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.071 -1.018 . . . . 0.0 110.406 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.482 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 35.8 mt-30 -51.92 -46.48 64.66 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.501 -0.749 . . . . 0.0 109.752 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' HA ' ' A' ' 68' ' ' CYS . 0.5 OUTLIER -74.38 -18.6 60.65 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.095 -1.003 . . . . 0.0 109.695 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 1.148 ' CE2' HD23 ' A' ' 10' ' ' LEU . 10.5 t80 -63.17 -53.95 45.31 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.045 -1.034 . . . . 0.0 109.235 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.899 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.69 -46.21 66.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.975 ' CB ' ' HB2' ' B' ' 75' ' ' ALA . . . -56.18 -31.54 63.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.038 -1.039 . . . . 0.0 109.04 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.787 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -64.6 -65.05 0.73 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.787 HG23 ' CE2' ' A' ' 76' ' ' PHE . 41.3 t -56.55 -18.71 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.881 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -65.46 -48.92 71.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.353 -0.842 . . . . 0.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.9 OUTLIER -74.98 -64.16 1.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.354 -0.841 . . . . 0.0 109.745 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 1.013 HG22 HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.01 -22.01 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 O-C-N 120.407 -1.433 . . . . 0.0 109.627 -178.824 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.715 ' CG2' HD11 ' B' ' 11' ' ' ILE . 4.6 m -80.62 -65.8 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.91 -1.119 . . . . 0.0 108.876 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.7 t -80.1 -49.7 11.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.158 -0.963 . . . . 0.0 108.922 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.68 -33.77 0.08 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.607 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 82' ' ' THR . 11.9 t -74.17 -50.89 17.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.354 -0.841 . . . . 0.0 109.351 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -53.44 -55.69 23.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.922 . . . . 0.0 109.45 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -38.55 83.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 0.0 109.471 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.862 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -58.25 -75.13 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.254 -0.903 . . . . 0.0 109.66 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.807 HD21 ' HZ ' ' A' ' 73' ' ' PHE . 1.3 mt -75.58 -30.6 59.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 0.0 109.651 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 7' ' ' MET . 16.9 mt-10 -57.36 -59.1 5.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -0.954 . . . . 0.0 109.301 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' B' ' 1' ' ' SER . 1.0 OUTLIER -60.71 -49.66 76.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.291 -0.881 . . . . 0.0 109.378 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.562 ' HB1' HD12 ' A' ' 10' ' ' LEU . . . -66.0 -9.83 33.99 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.274 -0.891 . . . . 0.0 109.449 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' B' ' 3' ' ' LEU . 2.6 ttp -80.71 -53.84 6.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.436 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.97 -36.44 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.373 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.12 -46.72 64.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.203 -0.936 . . . . 0.0 109.469 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.587 ' HB3' ' HE1' ' B' ' 74' ' ' MET . 6.3 mt -61.3 -66.84 0.47 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.903 . . . . 0.0 109.427 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.715 HD11 ' CG2' ' A' ' 81' ' ' THR . 61.3 mt -41.76 -40.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.402 -0.811 . . . . 0.0 109.327 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 29.7 t70 -58.59 -54.06 51.37 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.26 -0.9 . . . . 0.0 109.066 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.692 HG21 HD13 ' A' ' 3' ' ' LEU . 1.7 t -51.5 -25.94 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.375 -0.828 . . . . 0.0 109.504 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.58 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 10.0 t80 -72.08 -46.39 57.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.897 -1.127 . . . . 0.0 109.666 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.522 ' NE2' ' HD3' ' B' ' 24' ' ' LYS . 43.9 t-80 -78.04 -14.68 59.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.262 -0.899 . . . . 0.0 110.454 -179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.525 ' O ' ' CG ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -90.41 -60.16 2.0 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.947 -1.096 . . . . 0.0 109.287 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.579 ' CD2' ' OE1' ' B' ' 34' ' ' GLU . 24.6 m-85 -61.63 -33.23 73.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.522 -0.736 . . . . 0.0 109.623 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.531 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 4.2 p -82.87 -11.35 58.28 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.172 -0.955 . . . . 0.0 109.658 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -102.77 9.31 55.26 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.525 ' CG ' ' O ' ' B' ' 16' ' ' GLN . 11.0 mtp85 -89.98 -33.95 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -1.159 . . . . 0.0 109.476 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.476 ' HG2' ' OE2' ' B' ' 31' ' ' GLU . 5.6 pt-20 -170.17 117.44 0.55 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.905 . . . . 0.0 109.384 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.54 -81.13 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' B' ' 24' ' ' LYS . 3.2 p30 -171.57 28.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -1.147 . . . . 0.0 109.555 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.522 ' HD3' ' NE2' ' B' ' 15' ' ' HIS . 1.6 ttmt 43.65 61.2 2.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.893 . . . . 0.0 109.508 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.508 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.2 OUTLIER -170.1 -34.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 0.0 109.678 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.531 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.0 OUTLIER -141.12 165.25 28.05 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.203 -0.935 . . . . 0.0 109.708 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 1.08 HD12 HD23 ' B' ' 32' ' ' LEU . 17.8 mt -87.77 148.76 24.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.303 -0.873 . . . . 0.0 109.262 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -116.55 72.64 0.82 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.688 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 62.32 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.461 -0.775 . . . . 0.0 110.578 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 0.3 OUTLIER -48.32 -37.52 16.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.197 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.665 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.9 mm-40 -58.27 -41.22 83.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.085 -1.009 . . . . 0.0 109.48 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 1.08 HD23 HD12 ' B' ' 27' ' ' LEU . 18.8 mt -64.46 -57.13 10.11 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.524 -0.735 . . . . 0.0 109.496 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 1.127 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.89 -68.78 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.252 -0.905 . . . . 0.0 110.055 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.579 ' OE1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -42.74 -49.82 5.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 109.779 -179.421 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.831 HD23 ' CE2' ' B' ' 76' ' ' PHE . 14.1 tp -49.12 -47.54 45.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.004 -1.06 . . . . 0.0 109.555 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.961 HD13 HG22 ' B' ' 53' ' ' VAL . 2.9 mt -63.84 -32.66 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' GLU . 66.3 m-20 -94.46 -77.33 0.46 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.05 . . . . 0.0 109.731 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.418 ' C ' ' O ' ' B' ' 37' ' ' ASN . 5.0 t-20 -42.68 -26.42 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.329 -0.857 . . . . 0.0 109.902 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.713 ' HG2' HD13 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -109.31 -46.24 3.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.084 -1.01 . . . . 0.0 109.922 -179.692 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.531 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 0.7 OUTLIER -104.89 61.65 0.7 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.065 -1.022 . . . . 0.0 109.503 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 1.001 HD13 HG21 ' B' ' 53' ' ' VAL . 29.7 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 83.1 -42.73 0.1 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.686 -0.634 . . . . 0.0 109.725 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.0 OUTLIER 179.55 -44.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.139 -0.976 . . . . 0.0 109.203 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.6 OUTLIER 162.36 58.52 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.362 -0.836 . . . . 0.0 109.243 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -90.42 -70.35 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.201 -0.937 . . . . 0.0 109.899 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.816 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.7 t -87.64 -20.89 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.094 -1.004 . . . . 0.0 109.601 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.127 HG11 ' CD ' ' B' ' 33' ' ' LYS . 54.7 t -76.9 -29.59 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.955 -1.091 . . . . 0.0 109.224 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.3 OUTLIER -90.11 -29.55 18.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.259 -0.901 . . . . 0.0 109.546 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -35.18 35.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.632 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 52' ' ' VAL . 11.1 m -58.63 -47.08 89.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 O-C-N 121.13 -0.981 . . . . 0.0 109.919 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' B' ' 57' ' ' MET . 8.2 tpp -42.01 -28.33 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.014 -1.054 . . . . 0.0 109.14 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 1.7 mp0 -80.71 -45.39 17.19 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.457 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.6 m -73.53 -67.21 0.61 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.405 -0.809 . . . . 0.0 109.39 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.973 HD22 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mt -40.61 -33.87 0.31 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.481 -0.762 . . . . 0.0 109.341 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 57' ' ' MET . 4.7 t0 -90.17 83.95 6.06 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.419 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -96.1 26.92 3.9 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.266 -0.896 . . . . 0.0 109.577 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.448 ' OD2' ' OD2' ' B' ' 69' ' ' ASP . 13.1 m-20 -127.93 -34.17 2.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 109.5 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.15 91.47 1.34 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 177.04 -32.71 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.219 -1.165 . . . . 0.0 108.669 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.13 26.49 4.9 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' B' ' 26' ' ' LYS . 23.8 pt-20 -136.43 124.46 22.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.236 -1.155 . . . . 0.0 109.374 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.57 166.05 19.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.188 -0.945 . . . . 0.0 110.009 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.6 OUTLIER -129.21 172.23 11.66 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.549 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -61.27 -52.66 63.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.489 -179.555 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.439 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.0 pt20 -56.34 -34.77 66.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.133 -0.98 . . . . 0.0 109.225 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.535 ' CA ' ' OE1' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -81.49 -20.2 40.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 108.877 179.561 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.613 ' CE1' HG12 ' B' ' 13' ' ' VAL . 3.9 t80 -65.7 -51.04 62.53 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.881 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -69.11 -46.15 68.41 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.279 -0.888 . . . . 0.0 108.902 179.503 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.975 ' HB2' ' CB ' ' A' ' 75' ' ' ALA . . . -64.74 -18.13 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.171 -0.956 . . . . 0.0 108.87 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.973 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -72.62 -62.78 1.33 Allowed 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.662 ' O ' HG23 ' B' ' 81' ' ' THR . 96.1 t -60.56 -27.58 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.899 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -69.26 -30.58 68.73 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.584 -0.697 . . . . 0.0 109.229 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.71 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 2.4 mmm -76.28 -71.05 0.41 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.17 -0.956 . . . . 0.0 108.643 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.753 HG11 HG12 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -44.6 -24.99 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 O-C-N 120.66 -1.275 . . . . 0.0 109.467 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.662 HG23 ' O ' ' B' ' 77' ' ' VAL . 4.9 p -75.38 -69.61 0.47 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 0.0 108.547 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.2 m -78.01 -53.6 7.24 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -35.96 -37.04 0.1 Allowed 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.257 0.551 . . . . 0.0 109.851 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' B' ' 82' ' ' THR . 5.2 t -88.2 -38.68 15.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.272 -0.892 . . . . 0.0 109.533 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' B' ' 82' ' ' THR . 3.2 t-160 -55.41 -21.23 14.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.479 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -87.59 -37.93 16.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.923 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 16.0 t80 . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.47 -179.979 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.43 ' HB3' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.95 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 1.9 mp0 -67.17 -73.01 0.15 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.216 -0.927 . . . . 0.0 109.455 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.672 HD21 HD23 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.52 -29.73 0.77 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.48 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 1' ' ' SER . 1.0 OUTLIER -65.72 -52.84 48.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.217 -0.927 . . . . 0.0 109.654 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -62.21 -26.1 68.17 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.209 -0.932 . . . . 0.0 109.494 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HB2' ' B' ' 6' ' ' ALA . . . -72.94 -24.41 60.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.515 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' B' ' 81' ' ' THR . 6.8 tpt -80.86 -55.84 4.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.434 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.9 p -60.97 -24.39 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.195 -0.941 . . . . 0.0 109.614 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.756 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -77.43 -66.64 0.81 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.558 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.872 HD13 HD22 ' B' ' 3' ' ' LEU . 4.1 mm? -43.82 -50.37 7.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.687 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.588 HG23 ' N ' ' A' ' 12' ' ' ASP . 17.9 tt -57.61 -45.61 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 109.604 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.588 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.07 -25.72 59.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.27 -0.894 . . . . 0.0 109.865 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.068 ' CG1' HD11 ' A' ' 35' ' ' LEU . 2.7 t -87.08 -28.15 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.1 -1.0 . . . . 0.0 109.725 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 7.1 t80 -66.3 -50.18 64.52 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.919 -1.113 . . . . 0.0 109.389 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -79.33 -31.99 43.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.25 -0.906 . . . . 0.0 109.684 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.4 tt0 -66.22 -65.59 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 109.544 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.559 ' CD1' HG13 ' A' ' 13' ' ' VAL . 19.7 m-85 -56.9 -45.0 82.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.31 -0.869 . . . . 0.0 109.604 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 18.1 m -67.8 -20.55 65.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.179 -0.951 . . . . 0.0 109.56 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.85 -7.79 76.19 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.438 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 23.8 mtp180 -70.68 -64.47 0.89 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -1.146 . . . . 0.0 109.482 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.37 170.05 11.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.278 -0.889 . . . . 0.0 109.438 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . -62.03 88.05 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER 162.07 89.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.379 -1.071 . . . . 0.0 109.307 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.42 35.14 0.76 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.259 -0.901 . . . . 0.0 109.672 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -151.13 16.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.191 -0.943 . . . . 0.0 109.682 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -170.31 168.25 8.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.124 -0.985 . . . . 0.0 109.579 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.884 HD22 ' HB3' ' A' ' 31' ' ' GLU . 89.2 mt -120.0 149.99 41.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.437 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.1 OUTLIER -105.33 94.27 5.13 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 -179.76 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HA ' ' SD ' ' A' ' 57' ' ' MET . 2.0 ttmt 37.01 -84.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.703 -0.623 . . . . 0.0 111.276 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.613 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.8 m -45.18 -46.96 12.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.916 -1.115 . . . . 0.0 109.919 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.884 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -45.38 -46.9 13.45 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.036 -1.04 . . . . 0.0 109.32 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.018 ' CD2' HD22 ' A' ' 60' ' ' LEU . 2.5 mp -60.81 -60.95 2.98 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.592 -0.692 . . . . 0.0 109.247 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.945 ' CD ' HG11 ' A' ' 53' ' ' VAL . 1.2 mmmm -38.93 -36.43 0.28 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.508 -0.745 . . . . 0.0 109.748 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -68.44 -61.49 1.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.111 -0.993 . . . . 0.0 109.255 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.068 HD11 ' CG1' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -41.41 -51.52 3.73 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.697 . . . . 0.0 109.882 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.051 HD13 HG22 ' A' ' 53' ' ' VAL . 53.9 mt -60.61 -50.94 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 110.435 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.75 12.04 4.3 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.972 -1.08 . . . . 0.0 109.955 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.46 ' O ' ' OE1' ' A' ' 39' ' ' GLU . 1.4 t-20 -140.83 12.17 2.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.776 ' CB ' HD12 ' B' ' 3' ' ' LEU . 6.8 mm-40 -151.55 -35.7 0.13 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.007 -1.058 . . . . 0.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.042 HD23 ' HA ' ' A' ' 36' ' ' ILE . 2.1 mm? -44.22 -74.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.018 -1.051 . . . . 0.0 109.432 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.576 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 2.1 p . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.92 HG13 HG21 ' A' ' 53' ' ' VAL . 3.3 mm . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.29 0.567 . . . . 0.0 109.683 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -44.12 -33.27 1.44 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.501 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' A' ' 50' ' ' GLN . 15.7 tt0 -179.85 68.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.522 ' HA ' HG21 ' A' ' 47' ' ' ILE . 2.9 mt-30 43.85 56.51 4.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.506 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.14 -69.98 0.69 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.244 -0.91 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.865 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.9 t -89.24 -12.35 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.188 -0.945 . . . . 0.0 109.534 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.051 HG22 HD13 ' A' ' 36' ' ' ILE . 95.0 t -82.52 -26.26 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.123 -0.985 . . . . 0.0 109.17 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -87.49 -36.55 17.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.136 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.88 -47.29 15.33 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.378 -0.826 . . . . 0.0 109.209 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.859 ' O ' HD12 ' A' ' 60' ' ' LEU . 1.5 p -62.96 -43.41 99.0 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 O-C-N 121.194 -0.941 . . . . 0.0 109.253 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.502 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -46.09 -42.36 13.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.45 179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -57.62 12.15 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 56' ' ' VAL . 6.0 t -63.6 -12.91 37.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.231 -0.918 . . . . 0.0 109.616 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.018 HD22 ' CD2' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -79.77 -30.04 40.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -0.858 . . . . 0.0 109.452 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 61' ' ' ASP . 0.5 OUTLIER -89.92 104.73 17.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -99.94 1.14 42.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.286 -0.884 . . . . 0.0 109.585 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.91 -22.49 6.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.933 . . . . 0.0 109.527 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 85.78 99.21 0.74 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER 167.34 -27.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.272 -1.134 . . . . 0.0 108.622 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.42 -14.59 30.28 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.402 ' OE2' ' N ' ' A' ' 67' ' ' GLU . 2.7 mm-40 -79.61 111.42 15.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -1.097 . . . . 0.0 109.31 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.4 t -69.68 156.55 38.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.88 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.508 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -118.57 171.83 7.91 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.418 -0.801 . . . . 0.0 108.843 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -62.63 -51.54 66.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.17 -0.956 . . . . 0.0 110.194 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.451 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.7 mt-30 -56.03 -33.1 64.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 0.0 109.062 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 1.1 mm-40 -81.79 -22.12 37.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.388 -0.82 . . . . 0.0 109.02 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.448 ' CE2' HD12 ' A' ' 10' ' ' LEU . 37.9 t80 -66.78 -58.03 5.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.393 -0.817 . . . . 0.0 109.1 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' MET . . . . . 1.045 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 4.1 tpt -64.35 -47.96 77.35 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 109.153 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.834 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -57.05 -29.48 63.46 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.157 -0.964 . . . . 0.0 108.686 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.791 ' CD2' HG23 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -62.0 -66.19 0.58 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.488 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.791 HG23 ' CD2' ' A' ' 76' ' ' PHE . 55.1 t -55.52 -22.2 11.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -59.79 -49.16 78.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.513 -0.742 . . . . 0.0 109.154 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 20.3 mtp -76.64 -65.67 0.91 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.84 0.829 . . . . 0.0 109.664 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.865 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -47.64 -21.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 120.449 -1.407 . . . . 0.0 110.108 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 21.9 m -83.49 -63.56 1.33 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 0.0 108.612 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.586 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.3 m -79.62 -53.13 7.14 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.26 -33.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.2 0.524 . . . . 0.0 109.946 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.6 t -89.54 -41.96 11.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.476 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.429 ' N ' ' O ' ' A' ' 82' ' ' THR . 13.8 m170 -50.88 -56.44 12.27 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 109.47 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.36 -19.47 65.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 36.7 t80 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.267 -0.895 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.485 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 20.4 m . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.756 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 3.8 mm-40 -73.08 -55.12 6.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 109.257 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.876 HD11 HD21 ' A' ' 35' ' ' LEU . 2.8 mt -76.51 -11.52 59.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.847 . . . . 0.0 109.418 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 7' ' ' MET . 0.1 OUTLIER -74.61 -54.57 7.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.192 -0.942 . . . . 0.0 108.815 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -20.01 58.79 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.303 -0.873 . . . . 0.0 109.068 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.65 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -81.96 -30.47 31.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.388 -0.82 . . . . 0.0 109.568 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' B' ' 4' ' ' GLU . 1.3 ppp? -80.32 -32.01 38.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.133 -0.979 . . . . 0.0 109.392 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.428 ' N ' ' HG3' ' B' ' 7' ' ' MET . 55.4 t -73.09 -49.13 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.127 -0.983 . . . . 0.0 109.17 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.95 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -69.11 -43.91 73.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.346 -0.846 . . . . 0.0 109.613 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 3' ' ' LEU . 50.0 mt -61.96 -28.3 69.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.209 -0.932 . . . . 0.0 109.802 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.958 HD13 ' CE2' ' B' ' 70' ' ' PHE . 5.2 mm -72.16 -43.45 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.374 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 1.3 t70 -67.8 -36.9 81.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.293 -0.88 . . . . 0.0 110.161 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.901 HG13 ' O ' ' B' ' 9' ' ' ALA . 1.3 m -75.03 -34.48 32.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.046 -1.034 . . . . 0.0 110.083 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 69.5 t80 -61.76 -52.23 65.07 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.685 -1.26 . . . . 0.0 109.234 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.429 ' O ' ' C ' ' B' ' 16' ' ' GLN . 29.1 m80 -74.71 -60.46 2.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.25 -0.906 . . . . 0.0 109.755 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 2.3 tt0 -42.73 -47.21 5.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.287 -0.883 . . . . 0.0 109.684 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.735 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.0 m-85 -58.29 -52.16 66.74 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.207 -0.933 . . . . 0.0 109.056 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' B' ' 26' ' ' LYS . 12.2 m -51.86 -27.06 11.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.439 -0.788 . . . . 0.0 109.551 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . -66.95 -41.51 93.26 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 1.3 mmt180 -43.66 -48.51 7.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -1.128 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' B' ' 20' ' ' ARG . 22.0 mt-10 -162.78 148.3 12.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.278 -0.889 . . . . 0.0 109.439 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 87.87 75.98 1.28 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' B' ' 22' ' ' GLY . 2.2 m-20 43.74 -148.8 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.177 -1.19 . . . . 0.0 109.523 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -144.5 68.8 1.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.432 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.3 -38.56 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.918 . . . . 0.0 109.471 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -113.15 169.88 8.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.917 . . . . 0.0 109.401 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 31' ' ' GLU . 12.8 mt -93.97 138.73 31.76 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -0.96 . . . . 0.0 109.612 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.554 ' O ' ' CG ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER -94.46 82.65 4.05 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.382 -0.824 . . . . 0.0 109.504 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.543 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 6.8 ttmt 44.43 -91.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.113 -0.992 . . . . 0.0 110.196 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 28' ' ' LYS . 45.0 m -43.22 -36.88 1.92 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.872 -1.143 . . . . 0.0 110.071 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 27' ' ' LEU . 1.4 mp0 -43.04 -51.43 5.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.084 -1.01 . . . . 0.0 110.352 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.997 HD13 HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -74.63 -35.67 62.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.19 -0.944 . . . . 0.0 109.068 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.542 ' HD3' HG11 ' B' ' 53' ' ' VAL . 1.5 ttpt -52.15 -27.67 15.17 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.054 -1.029 . . . . 0.0 108.741 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.512 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -83.32 -52.34 6.64 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.297 -0.877 . . . . 0.0 108.828 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.882 HD22 ' CE1' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -43.12 -38.96 2.6 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.438 -0.789 . . . . 0.0 108.98 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.722 HG23 ' HB2' ' B' ' 40' ' ' LEU . 3.8 mt -78.8 -39.1 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 O-C-N 121.561 -0.712 . . . . 0.0 109.318 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -75.94 -0.25 20.81 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.505 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.26 -53.08 3.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.161 -0.962 . . . . 0.0 109.069 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.511 ' HG2' HD22 ' A' ' 3' ' ' LEU . 1.0 OUTLIER -105.31 -28.48 10.88 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.001 179.609 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.764 HD11 HG13 ' B' ' 77' ' ' VAL . 74.3 mt -98.02 56.32 1.22 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.406 -0.809 . . . . 0.0 109.37 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.869 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.532 HG22 ' O ' ' B' ' 47' ' ' ILE . 4.8 mt . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -76.77 3.28 12.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.132 -0.98 . . . . 0.0 109.52 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.49 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 1.2 mm-40 -123.54 14.66 9.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.209 -0.932 . . . . 0.0 108.98 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.524 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 75.04 54.21 0.07 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.397 -0.814 . . . . 0.0 109.546 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.08 -70.8 0.65 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.192 -0.943 . . . . 0.0 109.502 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.915 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -93.87 -24.31 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.108 -0.995 . . . . 0.0 108.753 179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.542 HG11 ' HD3' ' B' ' 33' ' ' LYS . 45.8 t -77.22 -17.23 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.356 -0.84 . . . . 0.0 108.869 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.524 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 41.0 t0 -84.18 -46.71 11.6 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.365 -0.835 . . . . 0.0 109.113 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -71.45 -49.8 38.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.236 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.81 HG11 HG22 ' B' ' 80' ' ' VAL . 21.4 m -54.21 -46.74 68.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.134 -0.978 . . . . 0.0 109.352 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 7.4 tpt -43.54 -44.55 6.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 109.719 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -54.43 45.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.209 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.579 HG22 ' O ' ' B' ' 56' ' ' VAL . 4.9 t -71.55 -9.09 57.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 109.542 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.997 HD22 HD13 ' B' ' 32' ' ' LEU . 0.3 OUTLIER -90.88 -10.83 41.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.37 -0.831 . . . . 0.0 109.459 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.14 82.43 6.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 109.294 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -85.01 13.17 6.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -160.76 27.29 0.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.518 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' OD1' ' B' ' 65' ' ' ASP . . . 49.94 68.5 1.37 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' B' ' 64' ' ' GLY . 0.4 OUTLIER -177.06 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.275 -1.133 . . . . 0.0 108.603 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.12 8.25 25.8 Favored Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 1.4 mt-10 -69.91 85.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -1.136 . . . . 0.0 109.455 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' B' ' 60' ' ' LEU . 4.1 m -69.95 140.79 53.07 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -100.67 172.71 6.92 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.958 ' CE2' HD13 ' B' ' 11' ' ' ILE . 0.7 OUTLIER -64.97 -58.83 5.1 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.101 -0.999 . . . . 0.0 110.463 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.81 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.2 OUTLIER -50.92 -49.67 59.14 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.166 -0.959 . . . . 0.0 109.272 -179.511 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.642 ' CB ' ' CZ ' ' B' ' 76' ' ' PHE . 1.3 mm-40 -68.06 -24.56 65.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.382 -0.824 . . . . 0.0 109.021 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.882 ' CE1' HD22 ' B' ' 35' ' ' LEU . 1.7 t80 -66.05 -60.75 2.53 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.479 -0.763 . . . . 0.0 109.606 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.82 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 2.6 mtm -53.55 -34.86 59.77 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.0 109.159 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.834 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -68.86 -34.25 75.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.12 -0.987 . . . . 0.0 108.723 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CZ ' ' CB ' ' B' ' 72' ' ' GLU . 20.4 m-30 -65.31 -66.17 0.58 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.764 HG13 HD11 ' B' ' 40' ' ' LEU . 57.4 t -47.2 -26.72 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 1.045 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -56.95 -64.72 0.78 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 6.0 mtm -56.86 -61.91 2.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.197 -0.939 . . . . 0.0 109.408 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.915 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.35 -22.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 O-C-N 120.66 -1.275 . . . . 0.0 109.528 -179.183 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.533 ' CG2' ' CE ' ' A' ' 7' ' ' MET . 30.2 m -79.0 -69.46 0.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.929 -1.107 . . . . 0.0 109.055 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.3 t -76.41 -48.89 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.142 -0.974 . . . . 0.0 109.073 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.91 -35.16 0.09 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.749 -0.594 . . . . 0.0 110.022 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.7 t -89.64 -37.49 14.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -0.964 . . . . 0.0 109.712 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 85' ' ' HIS . 1.3 t60 -64.96 -12.12 46.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.205 -0.935 . . . . 0.0 109.551 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.5 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 5.6 pt-20 -90.15 -33.96 16.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 0.0 109.6 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 87' ' ' PHE . . . . . 0.488 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.5 t80 . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.507 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 49.7 m . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.516 ' HG3' ' CG2' ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.26 -95.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.895 . . . . 0.0 109.66 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.765 HD13 HG21 ' B' ' 13' ' ' VAL . 7.3 mp -47.23 -29.31 2.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.1 -1.0 . . . . 0.0 109.739 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.449 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.5 OUTLIER -52.14 -60.4 3.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.148 -0.97 . . . . 0.0 109.172 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -35.01 79.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.329 -0.857 . . . . 0.0 109.018 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.887 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -69.87 -10.76 59.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.88 -47.61 7.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.303 -0.873 . . . . 0.0 109.196 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.439 ' O ' HG22 ' A' ' 11' ' ' ILE . 52.4 t -64.68 -27.16 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.304 -0.873 . . . . 0.0 109.233 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.625 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -85.54 -58.29 2.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.341 -0.849 . . . . 0.0 109.366 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.8 mt -49.14 -34.28 13.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 0.0 109.337 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.602 HG23 ' N ' ' A' ' 12' ' ' ASP . 3.3 tt -76.21 -46.06 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 109.53 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -55.12 -21.32 12.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.331 -0.855 . . . . 0.0 109.552 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.661 HG22 ' HE2' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.13 -39.63 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.141 -0.974 . . . . 0.0 109.674 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 25.3 t80 -53.73 -41.92 67.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.819 -1.175 . . . . 0.0 108.858 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -79.25 -44.43 21.78 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.341 -0.849 . . . . 0.0 109.205 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' A' ' 15' ' ' HIS . 1.7 tt0 -44.4 -38.93 4.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.268 -0.895 . . . . 0.0 108.82 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.79 ' CE2' HD21 ' A' ' 35' ' ' LEU . 80.8 m-85 -94.08 -78.04 0.44 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.525 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 24.4 p 39.05 28.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.594 -0.691 . . . . 0.0 110.006 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' TYR . . . 76.9 51.82 6.12 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 17' ' ' TYR . 32.7 mtp180 -40.65 -29.52 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.5 -1.0 . . . . 0.0 109.732 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -98.5 85.89 3.47 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.237 -0.915 . . . . 0.0 109.428 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 103.69 91.87 2.22 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 9.8 t70 70.94 154.97 0.14 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.199 -1.177 . . . . 0.0 109.402 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.525 ' CA ' ' OG ' ' A' ' 18' ' ' SER . 10.9 mttp -134.64 60.44 1.7 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.514 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t-80 -130.42 -35.18 1.54 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.21 -0.931 . . . . 0.0 109.558 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.543 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -140.83 167.43 22.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.4 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD12 ' CD2' ' A' ' 32' ' ' LEU . 9.0 mt -88.92 170.06 11.03 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.138 -0.976 . . . . 0.0 109.719 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 2.6 ptmm? -138.92 71.12 1.38 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.375 -0.828 . . . . 0.0 109.238 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 64.9 -83.08 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.581 -0.699 . . . . 0.0 110.225 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 91.0 p -41.98 -55.57 3.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.559 ' OE1' ' CD1' ' A' ' 17' ' ' TYR . 2.8 mm-40 -45.92 -45.82 15.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.028 . . . . 0.0 108.717 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.81 HD12 ' SD ' ' A' ' 57' ' ' MET . 16.3 mt -52.14 -68.25 0.19 Allowed 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.717 ' HG2' HG11 ' A' ' 53' ' ' VAL . 19.3 mttt -38.27 -31.08 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.558 -0.714 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 31' ' ' GLU . 7.9 mm-40 -67.45 -67.61 0.44 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.085 -1.01 . . . . 0.0 109.169 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.79 HD21 ' CE2' ' A' ' 17' ' ' TYR . 18.6 mt -43.85 -45.69 7.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.337 -0.852 . . . . 0.0 109.461 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.12 HD11 ' CE1' ' A' ' 76' ' ' PHE . 44.7 mm -54.05 -62.0 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.384 -0.822 . . . . 0.0 109.672 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.411 ' C ' ' OD1' ' A' ' 38' ' ' ASN . 10.8 m120 -83.08 16.7 2.25 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.34 -0.85 . . . . 0.0 110.162 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m120 -142.06 16.94 2.1 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.037 -1.04 . . . . 0.0 109.742 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.952 ' OE2' HG13 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -158.4 -33.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.955 -1.091 . . . . 0.0 110.563 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.755 HD22 ' OE2' ' A' ' 39' ' ' GLU . 2.0 mm? -53.49 -68.94 0.13 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.926 -1.109 . . . . 0.0 109.644 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.499 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 1.048 HD13 HG21 ' A' ' 53' ' ' VAL . 1.2 mt . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 17.1 ptpt -40.1 -35.44 0.39 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.463 -0.773 . . . . 0.0 109.873 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 11.8 pt-20 178.13 -31.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.855 . . . . 0.0 109.435 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.555 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mt-30 165.17 50.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.328 -0.857 . . . . 0.0 109.147 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -90.32 -70.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.895 . . . . 0.0 110.135 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.775 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.7 OUTLIER -86.2 -23.37 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.127 -0.983 . . . . 0.0 109.954 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.048 HG21 HD13 ' A' ' 47' ' ' ILE . 83.7 t -81.69 -32.16 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 120.793 -1.192 . . . . 0.0 109.405 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.555 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -90.58 -28.35 18.52 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.188 -0.945 . . . . 0.0 109.499 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 10.3 tptm -87.34 -42.48 12.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.713 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -73.93 -29.8 26.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.118 -0.989 . . . . 0.0 109.127 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.81 ' SD ' HD12 ' A' ' 32' ' ' LEU . 6.9 tpt -49.42 -39.33 32.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.359 -0.838 . . . . 0.0 109.48 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.33 -48.2 20.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.859 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 3.9 t -66.1 -9.53 31.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.891 HD11 HG13 ' A' ' 56' ' ' VAL . 35.2 mt -82.68 -52.83 6.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 109.347 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.62 ' OD2' ' HE2' ' A' ' 57' ' ' MET . 1.0 OUTLIER -75.76 86.9 2.77 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.49 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.64 25.72 2.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 109.428 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -121.8 -27.76 4.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.46 94.67 1.02 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.7 -31.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.267 -1.137 . . . . 0.0 108.576 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.11 -23.91 19.92 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.543 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 4.8 mm-40 -83.94 136.7 33.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.22 -1.165 . . . . 0.0 109.409 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.529 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.84 170.47 13.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.223 -0.923 . . . . 0.0 109.927 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.4 OUTLIER -136.78 171.4 14.56 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.481 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.5 OUTLIER -61.4 -62.2 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.799 -1.188 . . . . 0.0 110.354 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.697 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 0.9 OUTLIER -47.79 -28.67 2.66 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.034 -1.041 . . . . 0.0 108.918 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.529 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -73.22 -43.13 61.77 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.548 -0.72 . . . . 0.0 109.64 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.608 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 29.2 t80 -56.24 -54.36 46.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.875 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -56.4 -58.19 9.08 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.047 -1.033 . . . . 0.0 109.344 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -57.75 -17.38 15.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.2 -0.938 . . . . 0.0 108.975 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 1.12 ' CE1' HD11 ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.66 -70.43 0.32 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.457 -0.777 . . . . 0.0 109.138 179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.952 HG13 ' OE2' ' A' ' 39' ' ' GLU . 46.5 t -52.23 -29.52 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.427 -0.795 . . . . 0.0 109.188 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.22 -41.95 96.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.28 -0.888 . . . . 0.0 109.709 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.693 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.3 mtm -78.19 -70.42 0.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 109.73 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.898 HG11 HD12 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -43.82 -23.96 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.472 -1.393 . . . . 0.0 109.695 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.586 ' N ' HD11 ' A' ' 40' ' ' LEU . 16.8 m -80.34 -68.13 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.0 108.871 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.2 t -77.51 -49.3 15.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.181 -0.949 . . . . 0.0 108.796 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.05 -43.34 0.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.05 -28.76 18.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.314 -0.866 . . . . 0.0 109.607 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 81' ' ' THR . 16.5 t-160 -69.65 -9.69 55.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.907 . . . . 0.0 109.592 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.44 -10.16 50.08 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.203 -0.936 . . . . 0.0 109.497 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 0.0 109.547 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.462 ' HB3' ' HB2' ' B' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.625 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -59.68 -72.53 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.196 -0.94 . . . . 0.0 109.833 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.75 HD22 ' N ' ' B' ' 3' ' ' LEU . 3.6 mm? -73.69 -31.64 63.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.0 109.89 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.462 ' HB2' ' HB3' ' B' ' 1' ' ' SER . 3.3 tt0 -56.97 -58.92 6.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.212 -0.93 . . . . 0.0 109.389 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -64.36 -31.09 72.16 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.86 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -75.97 -14.01 60.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.0 109.507 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.539 ' O ' HD12 ' B' ' 11' ' ' ILE . 2.4 mtp -86.87 -37.75 17.4 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 24.6 t -73.83 -34.64 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -0.907 . . . . 0.0 109.397 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.76 -43.27 37.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.663 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.677 HD13 ' CZ ' ' B' ' 73' ' ' PHE . 3.4 mm? -66.47 -55.46 15.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.539 HD12 ' O ' ' B' ' 7' ' ' MET . 45.0 mt -52.35 -47.8 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -0.858 . . . . 0.0 109.72 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -63.16 -33.74 76.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.607 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.779 ' CG1' HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -73.53 -15.69 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.224 -0.923 . . . . 0.0 109.339 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 13.4 t80 -82.89 -44.98 14.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.965 -1.084 . . . . 0.0 108.981 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.456 ' O ' ' OG ' ' B' ' 18' ' ' SER . 75.1 m-70 -66.24 -31.21 71.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.411 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.492 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 4.2 tt0 -81.04 -50.46 9.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.158 -0.964 . . . . 0.0 109.407 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.861 ' O ' HD22 ' B' ' 27' ' ' LEU . 10.0 m-85 -78.68 4.03 14.8 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.308 -0.87 . . . . 0.0 109.574 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.554 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.1 p -83.36 41.45 0.77 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.194 -0.941 . . . . 0.0 109.76 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . 103.99 55.67 0.77 Allowed Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' B' ' 16' ' ' GLN . 11.9 mtp85 -45.02 -26.39 0.43 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.31 -1.112 . . . . 0.0 109.132 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -132.06 117.22 18.08 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.327 -0.858 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.04 -109.62 3.76 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -63.62 178.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 109.421 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' B' ' 18' ' ' SER . 15.4 ttmm -161.51 56.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.517 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -161.64 -36.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.587 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.482 ' C ' HD23 ' B' ' 27' ' ' LEU . 33.1 mtmt -131.67 170.16 15.16 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.144 -0.972 . . . . 0.0 109.481 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.861 HD22 ' O ' ' B' ' 17' ' ' TYR . 4.0 mt -95.29 142.9 27.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.172 -0.955 . . . . 0.0 109.918 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.523 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 9.4 pttp -124.32 74.29 1.3 Allowed 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.418 -0.801 . . . . 0.0 108.874 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.678 ' HA ' HD12 ' B' ' 32' ' ' LEU . 4.6 tppt? 68.3 -81.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.692 -0.63 . . . . 0.0 110.283 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -49.47 -46.02 47.52 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.083 -1.011 . . . . 0.0 110.406 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' CG ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -58.18 -34.64 70.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.0 -1.062 . . . . 0.0 109.618 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.807 HD23 HD12 ' B' ' 27' ' ' LEU . 12.1 mt -67.98 -69.57 0.31 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.478 -0.763 . . . . 0.0 109.51 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.477 ' HG3' HG11 ' B' ' 53' ' ' VAL . 8.8 mtpt -40.76 -27.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.396 -0.815 . . . . 0.0 110.171 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.498 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.5 OUTLIER -76.91 -58.75 3.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.034 -1.041 . . . . 0.0 109.424 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.807 HD21 ' CE1' ' B' ' 73' ' ' PHE . 23.4 tp -41.37 -47.16 3.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.716 HG23 HD12 ' B' ' 40' ' ' LEU . 1.3 mp -78.16 -38.95 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.0 110.082 -179.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' B' ' 33' ' ' LYS . 4.6 m120 -80.29 4.53 17.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.927 -1.108 . . . . 0.0 110.044 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.465 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 1.0 OUTLIER -126.68 -16.08 5.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.09 -1.006 . . . . 0.0 109.937 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 64.9 mm-40 -123.86 -9.74 7.76 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.109 -0.995 . . . . 0.0 109.633 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.716 HD12 HG23 ' B' ' 36' ' ' ILE . 37.0 mt -117.29 67.17 0.74 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.199 -0.938 . . . . 0.0 109.685 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 O-C-N 121.336 -0.852 . . . . 0.0 109.087 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.695 HD12 HG23 ' B' ' 53' ' ' VAL . 24.6 mm . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 5.8 mttt 83.09 -42.67 0.1 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.692 -0.63 . . . . 0.0 109.713 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.8 OUTLIER 164.52 -25.26 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.097 -1.002 . . . . 0.0 109.368 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.511 ' HB2' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 165.11 51.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.265 -0.897 . . . . 0.0 109.574 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.478 ' OE1' ' HE3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.14 -70.66 0.66 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.135 -0.978 . . . . 0.0 109.558 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.776 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.4 t -90.85 -24.79 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.231 -0.918 . . . . 0.0 108.982 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.695 HG23 HD12 ' B' ' 47' ' ' ILE . 69.7 t -72.39 -22.22 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.283 -0.885 . . . . 0.0 108.928 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.511 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 7.6 t70 -86.91 -53.47 4.88 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.302 -0.874 . . . . 0.0 109.111 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.47 -42.52 78.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.287 -0.883 . . . . 0.0 109.122 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.905 ' HB ' HD13 ' B' ' 60' ' ' LEU . 35.2 m -61.85 -47.36 93.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 O-C-N 121.235 -0.915 . . . . 0.0 109.196 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.606 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.08 -27.62 0.22 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.4 OUTLIER -77.58 -47.44 19.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.336 -0.853 . . . . 0.0 108.699 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.454 ' O ' ' C ' ' B' ' 60' ' ' LEU . 9.2 m -76.26 -66.44 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.378 -0.826 . . . . 0.0 109.095 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.905 HD13 ' HB ' ' B' ' 56' ' ' VAL . 1.5 mp -39.9 -30.16 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.51 -0.744 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' B' ' 59' ' ' THR . 48.9 t0 -90.21 110.68 21.71 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.232 -0.918 . . . . 0.0 109.425 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -141.98 25.5 1.93 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -0.955 . . . . 0.0 109.531 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.62 -15.54 8.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 90.33 55.31 1.97 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 8.0 t70 179.28 -33.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.228 -1.16 . . . . 0.0 108.634 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.428 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.1 34.34 2.37 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.476 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 7.2 mm-40 -104.87 114.44 28.64 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -1.147 . . . . 0.0 109.434 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.555 ' HB2' HD21 ' B' ' 32' ' ' LEU . 12.0 t -70.1 158.31 35.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.278 -0.889 . . . . 0.0 109.617 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -132.05 171.18 13.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.405 -0.809 . . . . 0.0 108.924 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.471 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -53.2 -48.36 68.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.321 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.435 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.0 pt20 -59.27 -36.01 74.75 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.345 -0.847 . . . . 0.0 108.826 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.489 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.6 OUTLIER -82.23 -12.34 58.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.409 -0.807 . . . . 0.0 109.217 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.807 ' CE1' HD21 ' B' ' 35' ' ' LEU . 3.8 t80 -73.11 -57.92 3.68 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.851 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 46.4 mtt -68.31 -44.33 75.66 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.388 -0.82 . . . . 0.0 109.332 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.82 -40.6 89.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -0.876 . . . . 0.0 109.406 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.883 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.2 t80 -57.43 -68.73 0.21 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.271 -0.893 . . . . 0.0 109.131 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.649 HG13 HD21 ' B' ' 40' ' ' LEU . 71.2 t -52.45 -22.69 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -62.07 -50.87 70.25 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.56 -0.713 . . . . 0.0 109.206 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 29.7 mtp -74.01 -66.92 0.66 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.43 -0.794 . . . . 0.0 109.366 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.757 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -42.59 -25.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.502 -1.374 . . . . 0.0 109.631 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.494 ' N ' ' O ' ' B' ' 79' ' ' MET . 5.9 m -78.63 -70.01 0.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.982 -1.074 . . . . 0.0 108.722 178.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.562 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.1 t -77.82 -49.07 15.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.226 -0.921 . . . . 0.0 108.765 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -39.39 -44.09 1.29 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.684 -0.635 . . . . 0.0 109.543 179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 46.4 t -73.27 -40.37 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.861 . . . . 0.0 109.478 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.17 -13.49 48.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.22 -0.925 . . . . 0.0 109.398 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -77.23 -40.57 44.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.46 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.467 ' HG2' ' CB ' ' B' ' 9' ' ' ALA . 41.4 tt0 -80.29 -61.75 1.88 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.446 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.971 HD11 HD13 ' B' ' 10' ' ' LEU . 12.1 tp -64.43 -11.09 29.75 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.269 -0.895 . . . . 0.0 109.473 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -89.16 -53.32 4.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.243 -0.911 . . . . 0.0 109.411 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.86 -27.28 63.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.911 . . . . 0.0 109.373 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -70.2 -32.67 70.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.412 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.589 ' HE1' ' HG ' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -71.33 -43.33 67.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.0 t -71.45 -28.4 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.0 109.656 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -78.39 -68.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.927 . . . . 0.0 109.581 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.846 ' CD2' HD13 ' B' ' 3' ' ' LEU . 81.4 mt -43.71 -48.51 7.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.591 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.86 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -58.97 -44.45 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.867 . . . . 0.0 109.633 -179.886 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.54 ' N ' HG23 ' A' ' 11' ' ' ILE . 5.8 t70 -66.65 -19.2 65.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 110.063 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.082 HG11 HD11 ' A' ' 35' ' ' LEU . 2.7 t -88.58 -29.51 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.03 -1.044 . . . . 0.0 109.607 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -71.33 -46.06 61.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.824 -1.172 . . . . 0.0 109.12 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' ' HG2' ' A' ' 24' ' ' LYS . 16.4 t-80 -77.8 -34.71 51.99 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.538 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -68.94 -63.83 0.98 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.919 . . . . 0.0 109.418 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.843 ' CD1' HG13 ' A' ' 13' ' ' VAL . 36.7 m-85 -53.73 -38.52 64.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.251 -0.905 . . . . 0.0 109.435 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 18.7 m -68.39 -30.97 70.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.17 -0.956 . . . . 0.0 109.492 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.462 ' HA2' ' HG3' ' A' ' 24' ' ' LYS . . . -57.22 -19.06 30.6 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.6 mmt180 -72.3 -38.06 68.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.248 -1.148 . . . . 0.0 109.444 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.472 ' OE2' ' HB2' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -78.26 164.15 25.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.242 -0.912 . . . . 0.0 109.491 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -50.51 -51.91 30.65 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.472 ' HB2' ' OE2' ' A' ' 21' ' ' GLU . 42.5 m-20 -78.17 -173.35 3.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -1.169 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HG3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -142.08 56.06 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 109.449 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.506 ' CG ' ' O ' ' A' ' 25' ' ' HIS . 76.0 t60 -169.99 32.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 109.483 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 9.2 ptpt -170.03 170.31 7.61 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.197 -0.94 . . . . 0.0 109.524 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.887 HD22 ' HB3' ' A' ' 31' ' ' GLU . 87.4 mt -134.64 129.96 35.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 109.78 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 1.034 ' O ' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -78.75 166.51 22.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.181 -0.95 . . . . 0.0 108.763 179.266 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.478 ' CG ' ' SD ' ' A' ' 57' ' ' MET . 11.3 mttt -42.65 -27.22 0.16 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 0.0 109.672 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -77.59 -58.38 3.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.968 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.887 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.6 mm-40 -46.76 -42.83 17.5 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.087 -1.008 . . . . 0.0 109.296 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.034 HD12 ' O ' ' A' ' 28' ' ' LYS . 1.7 mp -59.03 -65.87 0.6 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.558 -0.714 . . . . 0.0 109.204 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.701 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -41.58 -32.09 0.33 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.311 -0.868 . . . . 0.0 109.685 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -67.48 -61.73 1.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.212 -0.93 . . . . 0.0 109.468 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.082 HD11 HG11 ' A' ' 13' ' ' VAL . 2.0 mm? -40.92 -51.35 3.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.912 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.929 HG21 HD11 ' A' ' 47' ' ' ILE . 46.6 mt -62.07 -44.17 98.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 110.025 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HG12 ' A' ' 47' ' ' ILE . 72.7 m-20 -88.13 9.93 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.0 109.954 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 1.7 t-20 -105.62 -26.39 11.87 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.118 -0.989 . . . . 0.0 109.085 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.986 ' OE2' HD13 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -134.88 -35.3 0.87 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.405 -0.809 . . . . 0.0 109.547 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.685 HD12 ' N ' ' A' ' 40' ' ' LEU . 7.8 mp -86.32 15.1 5.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.569 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.929 HD11 HG21 ' A' ' 36' ' ' ILE . 34.8 mm . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.505 ' CG ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 43.81 -81.99 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.933 0.873 . . . . 0.0 110.478 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 47' ' ' ILE . 13.4 mm-40 -46.02 -33.55 3.47 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.523 ' HA ' ' CG2' ' A' ' 47' ' ' ILE . 1.3 tt0 76.4 32.88 0.56 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 109.351 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 55' ' ' LYS . 3.3 mm-40 -72.69 -49.49 31.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.529 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.814 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.3 OUTLIER -91.52 -18.16 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.197 -0.939 . . . . 0.0 109.37 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.777 ' CG2' HG21 ' A' ' 47' ' ' ILE . 25.1 t -82.0 -37.84 15.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 120.793 -1.192 . . . . 0.0 109.022 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.09 -29.66 17.18 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.983 -1.073 . . . . 0.0 109.3 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 25.1 tttm -90.91 -35.51 14.69 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.321 -0.862 . . . . 0.0 110.559 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.716 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -90.52 -25.64 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 120.846 -1.159 . . . . 0.0 110.361 -178.924 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.838 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -71.96 -49.62 35.78 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.848 -1.157 . . . . 0.0 109.22 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -35.84 74.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.12 -0.988 . . . . 0.0 108.82 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 5.6 t -90.31 -9.83 46.35 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.443 -0.785 . . . . 0.0 109.422 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -65.89 -45.96 80.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.368 -0.833 . . . . 0.0 109.448 -179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.429 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 9.0 m-20 -61.34 88.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.42 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -71.63 -10.27 59.52 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 0.0 109.504 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.78 -37.29 10.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.516 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 97.78 93.37 1.93 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 39.1 t0 178.61 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.269 -1.136 . . . . 0.0 108.658 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 110.18 19.08 8.24 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 26' ' ' LYS . 53.5 mt-10 -127.15 129.25 47.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -1.137 . . . . 0.0 109.47 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 8.6 t -69.74 155.54 40.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.639 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.503 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -126.17 171.44 10.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -61.47 -50.46 72.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.124 -0.985 . . . . 0.0 110.501 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' HG2' ' B' ' 79' ' ' MET . 2.8 pt20 -58.4 -40.09 81.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.947 . . . . 0.0 108.836 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.521 ' HG3' HD23 ' A' ' 60' ' ' LEU . 1.1 tt0 -80.6 -12.24 59.54 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.477 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 19.3 t80 -69.94 -51.99 28.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.197 -0.94 . . . . 0.0 108.503 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.833 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 26.9 mtt -68.98 -43.47 74.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.957 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -67.33 -20.32 65.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 108.652 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.704 ' HE1' HD11 ' A' ' 36' ' ' ILE . 1.1 t80 -68.13 -57.95 5.24 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.651 HG21 HD12 ' B' ' 3' ' ' LEU . 55.0 t -66.86 -25.87 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 121.334 -0.854 . . . . 0.0 108.758 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -68.51 -27.27 65.97 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.429 -0.795 . . . . 0.0 109.065 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.66 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 11.6 mtm -84.2 -70.09 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 108.971 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.814 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -45.65 -23.02 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 O-C-N 120.302 -1.498 . . . . 0.0 109.892 -179.658 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.564 HG23 ' N ' ' A' ' 82' ' ' THR . 4.0 t -85.25 -52.26 6.03 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.747 -1.221 . . . . 0.0 109.327 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.619 HG21 ' HB3' ' B' ' 70' ' ' PHE . 1.1 t -90.82 -51.31 5.43 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.705 -1.221 . . . . 0.0 107.705 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.02 -42.06 0.39 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.369 0.604 . . . . 0.0 109.628 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.42 -37.02 23.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.289 -0.882 . . . . 0.0 109.428 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.422 ' N ' ' O ' ' A' ' 82' ' ' THR . 2.8 t-160 -60.19 -16.15 30.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -85.89 -38.36 18.14 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.219 -0.926 . . . . 0.0 109.43 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 0.0 109.451 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.504 ' HG3' ' CG2' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -45.52 -71.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.255 -0.903 . . . . 0.0 109.622 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 1.005 ' CD2' HG21 ' A' ' 13' ' ' VAL . 4.0 mm? -57.6 -20.22 31.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.278 -0.889 . . . . 0.0 109.816 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -62.58 -62.38 1.78 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.196 -0.94 . . . . 0.0 109.521 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -59.39 -40.38 86.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.272 -0.892 . . . . 0.0 109.661 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -68.45 -20.23 64.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.196 -0.94 . . . . 0.0 109.566 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.647 ' O ' HD12 ' B' ' 11' ' ' ILE . 0.0 OUTLIER -74.98 -59.37 2.77 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.548 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.663 HG12 ' OD2' ' B' ' 12' ' ' ASP . 3.4 t -76.52 -11.39 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 109.473 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.696 ' O ' HG13 ' B' ' 13' ' ' VAL . . . -81.85 -68.41 0.7 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.265 -0.897 . . . . 0.0 109.533 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.971 HD13 HD11 ' A' ' 3' ' ' LEU . 3.5 mm? -62.23 -30.09 70.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.431 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.647 HD12 ' O ' ' B' ' 7' ' ' MET . 74.2 mt -69.85 -47.55 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.903 -1.123 . . . . 0.0 108.785 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.663 ' OD2' HG12 ' B' ' 8' ' ' VAL . 0.5 OUTLIER -53.62 -37.86 63.47 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.94 HG11 HD13 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -72.99 -40.41 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 O-C-N 121.136 -0.978 . . . . 0.0 109.495 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 5.9 t80 -45.61 -47.21 14.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.836 -1.165 . . . . 0.0 108.224 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -80.3 -26.93 38.62 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.436 -0.79 . . . . 0.0 109.551 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -68.06 -70.15 0.28 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.995 . . . . 0.0 108.915 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 1.0 ' CD2' HD22 ' B' ' 35' ' ' LEU . 40.3 m-85 -49.71 -48.79 49.66 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.333 -0.854 . . . . 0.0 109.319 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 81.2 p -56.33 -35.35 67.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 109.716 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.455 ' HA2' ' HG2' ' B' ' 24' ' ' LYS . . . -66.58 -36.25 91.12 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 2.5 mmt180 -44.01 -28.29 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.276 -1.131 . . . . 0.0 109.513 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.475 ' HB3' ' HE3' ' B' ' 28' ' ' LYS . 5.9 mm-40 -126.64 156.11 41.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.452 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.43 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . -44.03 161.49 0.07 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.441 ' HB2' ' NZ ' ' B' ' 26' ' ' LYS . 25.6 m-20 55.18 100.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.266 -1.138 . . . . 0.0 109.447 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.455 ' HG2' ' HA2' ' B' ' 19' ' ' GLY . 15.0 mtmt -99.34 64.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.472 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.86 8.32 2.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.221 -0.925 . . . . 0.0 109.647 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.11 170.19 7.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.173 -0.955 . . . . 0.0 109.591 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' B' ' 31' ' ' GLU . 15.5 mt -107.63 148.84 28.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 21' ' ' GLU . 1.9 ptpt -124.74 85.47 2.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.692 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.501 ' HG2' ' N ' ' B' ' 30' ' ' SER . 24.5 ttmt 59.66 -86.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.371 -0.831 . . . . 0.0 110.231 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.501 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 10.1 m -42.97 -56.37 3.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 0.0 110.184 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.3 mp0 -47.49 -42.15 22.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.057 -1.027 . . . . 0.0 109.538 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.641 HD21 ' HB2' ' B' ' 27' ' ' LEU . 26.6 mt -55.39 -61.79 2.11 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.598 -0.689 . . . . 0.0 109.476 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.756 ' HE2' HG11 ' B' ' 53' ' ' VAL . 6.0 ttmt -47.89 -70.19 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.272 -0.893 . . . . 0.0 109.705 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.476 ' OE2' ' HA ' ' B' ' 31' ' ' GLU . 18.8 pt-20 -44.07 -28.76 0.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.16 -0.962 . . . . 0.0 109.463 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 1.0 HD22 ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -58.75 -57.74 11.66 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.848 . . . . 0.0 109.479 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.888 HG23 HD22 ' B' ' 40' ' ' LEU . 2.6 mp -74.07 -55.11 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.687 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.422 ' C ' ' O ' ' B' ' 36' ' ' ILE . 4.9 m120 -41.75 -27.6 0.12 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.308 -0.87 . . . . 0.0 109.771 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.524 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 3.1 m-20 -90.79 -45.65 8.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.189 -0.944 . . . . 0.0 109.549 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CG1' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -73.25 -65.65 0.78 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.165 -0.959 . . . . 0.0 109.511 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.888 HD22 HG23 ' B' ' 36' ' ' ILE . 8.5 mp -62.88 -49.71 73.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.257 -0.902 . . . . 0.0 109.48 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.203 -0.936 . . . . 0.0 109.376 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.753 HG21 ' HB ' ' B' ' 53' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' B' ' 49' ' ' GLU . 2.8 ptpt -43.41 -26.89 0.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.853 . . . . 0.0 109.528 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.517 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.1 tt0 178.36 -32.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.449 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.53 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 165.09 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.287 -0.883 . . . . 0.0 109.451 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -70.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.18 -0.95 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.905 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -90.18 -24.37 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.206 -0.934 . . . . 0.0 109.238 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.756 HG11 ' HE2' ' B' ' 33' ' ' LYS . 40.0 t -75.97 -29.86 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.219 -0.926 . . . . 0.0 108.885 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.53 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 6.8 t0 -79.82 -39.67 30.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.326 -0.859 . . . . 0.0 108.895 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.543 ' O ' HG23 ' B' ' 59' ' ' THR . 44.3 mmtt -65.54 -51.93 56.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 109.029 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.88 HG22 ' O ' ' B' ' 52' ' ' VAL . 16.5 m -55.8 -45.93 79.73 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 O-C-N 121.287 -0.883 . . . . 0.0 109.641 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.644 ' HE1' ' HA2' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -39.01 -31.66 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.809 -1.182 . . . . 0.0 110.224 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.465 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.1 OUTLIER -90.63 -35.98 14.66 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.142 -0.974 . . . . 0.0 109.361 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.568 ' OG1' HD23 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -73.15 -60.33 2.29 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.387 -0.82 . . . . 0.0 110.031 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.627 ' CD1' ' CG ' ' B' ' 76' ' ' PHE . 2.9 mt -45.33 -44.21 11.45 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.923 . . . . 0.0 109.61 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 19.9 p-10 -89.95 111.53 22.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 109.494 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -98.34 -23.13 15.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.569 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -82.26 -20.01 38.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.552 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.26 94.21 0.61 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 173.11 -30.62 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.259 -1.142 . . . . 0.0 108.599 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.644 ' HA2' ' HE1' ' B' ' 57' ' ' MET . . . 110.29 21.14 7.08 Favored Glycine 0 N--CA 1.485 1.926 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -107.74 99.72 9.17 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.246 -1.149 . . . . 0.0 109.409 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 17.2 t -72.43 157.4 37.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.191 -0.943 . . . . 0.0 109.698 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 1.1 m-20 -117.17 171.58 7.85 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.619 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -59.05 -50.2 74.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.305 -179.715 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.446 ' CG ' ' HG2' ' A' ' 79' ' ' MET . 18.4 mt-30 -55.81 -45.53 78.28 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.27 -0.894 . . . . 0.0 108.944 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.484 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -76.82 -13.29 60.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.408 -0.807 . . . . 0.0 109.395 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.648 ' HE1' HD21 ' B' ' 35' ' ' LEU . 6.5 t80 -70.72 -66.88 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.191 -0.943 . . . . 0.0 108.607 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.893 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 4.1 mtt -58.59 -39.03 79.24 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.341 -0.849 . . . . 0.0 108.884 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.957 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -64.64 -29.8 70.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.294 -0.879 . . . . 0.0 109.059 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.799 ' CE1' HG11 ' B' ' 56' ' ' VAL . 2.0 t80 -64.45 -63.7 1.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.422 -0.798 . . . . 0.0 109.287 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.726 ' CG2' HD12 ' B' ' 35' ' ' LEU . 49.5 t -56.9 -25.71 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.334 -0.854 . . . . 0.0 109.111 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.833 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -66.11 -41.81 90.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.325 -0.859 . . . . 0.0 109.415 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.0 mtm -73.79 -67.1 0.63 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.261 -0.899 . . . . 0.0 109.41 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.905 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.46 -25.04 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 120.637 -1.289 . . . . 0.0 109.247 -179.576 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.567 HG23 ' CE ' ' A' ' 7' ' ' MET . 13.0 m -76.3 -70.05 0.47 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.154 -0.966 . . . . 0.0 108.963 178.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.6 t -77.13 -49.53 15.03 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.171 -0.956 . . . . 0.0 108.922 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.71 -31.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.757 -0.589 . . . . 0.0 109.774 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.477 ' N ' ' O ' ' B' ' 82' ' ' THR . 47.6 t -87.47 -42.25 12.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.317 -0.864 . . . . 0.0 109.535 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.2 OUTLIER -65.69 -9.96 32.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 109.536 -179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -17.65 64.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.191 -0.943 . . . . 0.0 109.506 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 65.1 t80 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' GLU . 1.3 m . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.635 ' CG ' HG23 ' B' ' 13' ' ' VAL . 0.5 OUTLIER -73.9 -38.89 64.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.077 HD12 HG21 ' B' ' 77' ' ' VAL . 2.9 mm? -80.33 -34.39 36.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.26 -0.9 . . . . 0.0 109.43 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' A' ' 1' ' ' SER . 25.9 tt0 -60.13 -58.34 8.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -63.11 -38.78 92.53 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.22 -0.925 . . . . 0.0 109.254 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -73.22 -11.87 60.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.254 -0.904 . . . . 0.0 109.399 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -42.84 16.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.41 ' C ' HG22 ' A' ' 11' ' ' ILE . 22.0 t -75.53 -25.87 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.405 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.98 -50.01 9.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.224 -0.923 . . . . 0.0 109.514 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.548 HD12 ' CE2' ' A' ' 73' ' ' PHE . 3.9 mm? -62.52 -33.23 74.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.586 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -73.25 -46.33 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.926 . . . . 0.0 109.468 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.586 ' N ' HG23 ' A' ' 11' ' ' ILE . 9.5 t70 -65.83 -16.94 64.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.292 -0.88 . . . . 0.0 109.414 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.951 HG21 HD13 ' B' ' 3' ' ' LEU . 2.8 t -89.99 -37.3 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 0.0 109.359 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 68.7 t80 -62.83 -43.73 98.02 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.02 -1.05 . . . . 0.0 109.456 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 47.8 m170 -82.19 -49.93 9.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.303 -0.873 . . . . 0.0 109.795 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.2 tt0 -52.1 -59.75 4.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 109.612 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.719 ' CG ' HD21 ' A' ' 35' ' ' LEU . 44.7 m-85 -60.57 -48.71 80.59 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.897 . . . . 0.0 109.675 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 60.1 p -63.04 -11.61 20.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.208 -0.932 . . . . 0.0 109.689 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.521 ' HA2' ' CA ' ' A' ' 24' ' ' LYS . . . -70.69 -37.57 67.23 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 9.9 mmt180 -44.13 -41.63 5.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 8.5 tt0 -76.46 82.91 3.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 0.0 109.447 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.13 -91.15 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 21' ' ' GLU . 12.6 p30 -96.59 158.14 15.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' CA ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -89.63 119.91 30.46 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.31 -0.869 . . . . 0.0 109.449 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -169.58 -49.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -0.947 . . . . 0.0 109.693 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 3.6 mtmt -136.48 170.12 16.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 109.71 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD22 ' HB3' ' A' ' 31' ' ' GLU . 24.2 mt -102.43 150.36 23.44 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.292 -0.88 . . . . 0.0 109.463 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.523 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -115.56 70.05 0.74 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.171 -0.956 . . . . 0.0 109.854 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 63.34 -82.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.552 -0.717 . . . . 0.0 110.792 179.215 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.46 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 t -48.99 -29.09 4.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.034 -1.041 . . . . 0.0 110.32 -179.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.64 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.8 mp0 -66.84 -41.89 86.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.95 -1.094 . . . . 0.0 108.794 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.513 ' CD1' ' HE2' ' A' ' 57' ' ' MET . 14.8 mt -59.71 -61.22 2.78 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.78 ' CE ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -40.49 -45.06 2.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.645 -0.66 . . . . 0.0 109.437 179.627 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.507 ' OE1' ' ND2' ' A' ' 38' ' ' ASN . 0.7 OUTLIER -53.09 -61.32 2.38 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 109.319 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.719 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.2 mm? -54.81 -25.6 29.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.266 -0.896 . . . . 0.0 109.929 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.04 HG21 ' CG2' ' A' ' 53' ' ' VAL . 26.6 mm -64.09 -44.79 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.049 -1.032 . . . . 0.0 109.906 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' CA ' ' HB2' ' A' ' 41' ' ' SER . 9.8 m-20 -82.42 -52.73 6.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.114 -0.991 . . . . 0.0 109.931 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.507 ' ND2' ' OE1' ' A' ' 34' ' ' GLU . 3.7 m-80 -40.52 -52.27 2.83 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.39 -0.818 . . . . 0.0 110.248 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.909 ' OE2' HG22 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -96.28 -26.12 15.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.058 -1.026 . . . . 0.0 109.949 -179.506 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.798 HD21 ' SD ' ' B' ' 7' ' ' MET . 5.7 mt -135.51 67.46 1.48 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.471 ' HB2' ' CA ' ' A' ' 37' ' ' ASN . 11.4 t . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.863 . . . . 0.0 109.455 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.919 HD13 HG21 ' A' ' 53' ' ' VAL . 6.7 mt . . . . . 0 N--CA 1.495 1.782 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 0.6 OUTLIER 83.49 -43.5 0.1 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.509 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.5 mt-10 168.95 36.61 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.135 -0.978 . . . . 0.0 109.311 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 57.85 36.15 26.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 109.34 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -90.15 -37.38 14.23 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.262 -0.899 . . . . 0.0 109.756 -179.804 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.897 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.9 t -98.06 -28.42 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.108 -0.995 . . . . 0.0 109.83 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.04 ' CG2' HG21 ' A' ' 36' ' ' ILE . 25.3 t -73.15 -37.35 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.03 -1.044 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -22.32 21.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.143 -0.973 . . . . 0.0 109.281 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 23.8 tttt -84.1 -25.02 30.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.251 -0.906 . . . . 0.0 109.369 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.901 ' CB ' HD21 ' A' ' 60' ' ' LEU . 2.2 m -59.54 -48.26 87.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 O-C-N 121.235 -0.916 . . . . 0.0 109.852 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 15.0 tpp -45.34 -24.62 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.738 -1.226 . . . . 0.0 109.596 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 56' ' ' VAL . 5.7 mm-40 -88.81 -42.14 12.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 109.304 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.1 m -72.44 -62.39 1.46 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.926 . . . . 0.0 109.307 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.901 HD21 ' CB ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.23 44.04 1.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 109.493 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 57' ' ' MET . 15.8 p-10 -77.9 109.98 12.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 109.337 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.523 ' CB ' ' O ' ' A' ' 67' ' ' GLU . 36.8 t30 -49.46 -52.38 29.48 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.163 -0.961 . . . . 0.0 109.44 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -165.49 22.97 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.0 109.997 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.44 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 69.78 94.61 0.06 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.44 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.2 OUTLIER 170.13 -29.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.327 -1.102 . . . . 0.0 108.366 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 110.21 17.11 9.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 62' ' ' ASN . 2.7 pt-20 -113.09 91.2 3.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.27 -1.135 . . . . 0.0 109.109 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.542 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.44 130.89 43.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.681 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.5 m-20 -101.56 170.55 8.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.409 -0.807 . . . . 0.0 108.876 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.411 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.95 -48.69 64.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.033 -1.042 . . . . 0.0 110.457 -179.702 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.51 ' O ' ' CE ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.28 -41.09 65.21 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 109.416 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.587 ' OE1' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -74.53 -23.1 58.76 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 120.929 -1.107 . . . . 0.0 109.062 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.58 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 18.3 t80 -64.07 -52.73 57.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.197 -0.939 . . . . 0.0 108.534 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.872 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.37 -37.85 82.03 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.19 -0.944 . . . . 0.0 108.995 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.529 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -72.73 -19.19 61.43 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.98 . . . . 0.0 108.939 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.882 ' HB2' HD13 ' A' ' 60' ' ' LEU . 9.8 t80 -71.84 -68.31 0.47 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.493 -0.754 . . . . 0.0 109.27 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.909 HG22 ' OE2' ' A' ' 39' ' ' GLU . 39.3 t -66.42 -31.15 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.295 -0.878 . . . . 0.0 109.452 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 74' ' ' MET . . . -59.63 -40.66 88.36 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.282 -0.886 . . . . 0.0 109.384 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.728 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 2.1 mmt -77.76 -71.18 0.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.187 -0.945 . . . . 0.0 109.693 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 1.01 HG11 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.04 -24.39 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.296 -1.502 . . . . 0.0 109.736 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.509 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 13.1 m -77.09 -68.81 0.57 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 108.665 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.34 -49.74 11.11 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.728 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.19 -40.03 0.47 Allowed 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.334 0.588 . . . . 0.0 109.589 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.04 -32.88 16.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.263 -0.898 . . . . 0.0 109.477 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -66.34 -9.95 38.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.889 . . . . 0.0 109.534 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.38 -43.43 40.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.483 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.542 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.289 0.566 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -58.03 -75.74 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 109.66 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.951 HD13 HG21 ' A' ' 13' ' ' VAL . 5.9 mp -76.82 -29.68 56.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.606 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.542 ' HB3' ' CB ' ' B' ' 1' ' ' SER . 41.8 tt0 -58.03 -57.69 11.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.139 -0.976 . . . . 0.0 109.146 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.1 OUTLIER -61.27 -47.04 87.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.323 -0.861 . . . . 0.0 109.166 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.56 ' HB1' ' CB ' ' A' ' 6' ' ' ALA . . . -65.36 -12.68 54.42 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.288 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.876 ' O ' HD12 ' B' ' 11' ' ' ILE . 8.6 ttt -80.81 -44.45 18.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.362 -0.836 . . . . 0.0 109.296 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.38 -44.81 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.898 . . . . 0.0 109.315 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -67.84 -55.85 11.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.291 -0.88 . . . . 0.0 109.306 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.745 HD23 HD13 ' A' ' 3' ' ' LEU . 20.9 mt -45.37 -49.8 12.75 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.249 -0.907 . . . . 0.0 109.237 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.876 HD12 ' O ' ' B' ' 7' ' ' MET . 9.3 mt -60.17 -38.64 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.302 -0.874 . . . . 0.0 109.365 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -57.58 -28.64 63.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.829 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -82.92 -30.82 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.208 -0.933 . . . . 0.0 109.268 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.486 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 22.1 t80 -60.79 -51.1 70.75 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.84 -1.162 . . . . 0.0 109.211 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.458 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -80.16 -37.64 33.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.892 . . . . 0.0 109.615 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.2 tt0 -55.67 -65.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.211 -0.931 . . . . 0.0 109.487 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.581 ' CD2' ' HG ' ' B' ' 35' ' ' LEU . 28.8 m-85 -59.48 -49.73 76.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.552 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.534 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 53.2 p -57.95 -17.27 15.98 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.583 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.94 -37.22 16.53 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CZ ' ' OE1' ' B' ' 34' ' ' GLU . 56.4 mtp85 -46.22 -44.16 15.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -1.137 . . . . 0.0 109.465 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.58 169.97 17.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.432 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -48.37 -54.37 13.16 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' O ' ' O ' ' B' ' 18' ' ' SER . 73.2 m-20 -70.15 170.96 10.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -1.118 . . . . 0.0 109.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 18' ' ' SER . 1.0 OUTLIER -141.22 70.52 1.35 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.863 . . . . 0.0 109.466 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.486 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 0.9 OUTLIER -170.01 -36.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.362 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.536 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -121.89 170.19 10.04 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.919 . . . . 0.0 109.382 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.783 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.6 mp -102.21 144.92 30.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.952 . . . . 0.0 109.705 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -97.73 82.11 3.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' CG ' ' B' ' 57' ' ' MET . 0.0 OUTLIER 41.42 -83.87 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.591 -0.693 . . . . 0.0 110.955 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.604 ' N ' ' O ' ' B' ' 28' ' ' LYS . 4.7 t -48.5 -27.38 2.67 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.788 -1.195 . . . . 0.0 109.959 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.783 ' C ' HD23 ' B' ' 27' ' ' LEU . 2.8 mp0 -59.48 -47.01 87.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.894 -1.129 . . . . 0.0 108.38 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.655 HD21 ' CD ' ' B' ' 72' ' ' GLU . 4.1 mt -59.11 -42.99 91.85 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.965 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -45.64 -67.73 0.26 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.517 -0.739 . . . . 0.0 109.722 179.715 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.54 ' CG ' ' O ' ' B' ' 31' ' ' GLU . 12.7 pt-20 -45.49 -44.28 12.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.151 -0.968 . . . . 0.0 109.786 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.829 HD21 ' CG1' ' B' ' 13' ' ' VAL . 3.2 mt -52.28 -45.73 65.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.1 -1.0 . . . . 0.0 109.617 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 1.019 HG23 HD12 ' B' ' 40' ' ' LEU . 11.9 mt -73.14 -23.84 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.258 -0.901 . . . . 0.0 109.853 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -1.06 52.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.165 -0.959 . . . . 0.0 109.679 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -109.89 -20.06 12.89 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.159 -0.963 . . . . 0.0 109.285 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.697 ' C ' HD23 ' B' ' 40' ' ' LEU . 10.9 mm-40 -121.44 -22.14 6.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.316 -0.865 . . . . 0.0 109.612 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 1.019 HD12 HG23 ' B' ' 36' ' ' ILE . 4.5 mt -110.5 59.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.219 -0.926 . . . . 0.0 109.535 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.29 -0.881 . . . . 0.0 109.555 179.903 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.824 HD12 HG23 ' B' ' 53' ' ' VAL . 2.3 mm . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER -43.34 -38.92 2.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.5 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -163.92 70.15 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.267 -0.896 . . . . 0.0 109.211 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.538 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.5 pt20 41.91 37.48 0.81 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.435 -0.791 . . . . 0.0 109.546 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -65.23 -70.3 0.24 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 109.584 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 2.1 t -86.04 -13.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.125 -0.985 . . . . 0.0 109.439 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.965 HG11 ' CG ' ' B' ' 33' ' ' LYS . 69.0 t -81.03 -29.36 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.0 109.014 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.471 ' HB3' ' O ' ' B' ' 50' ' ' GLN . 33.6 t70 -87.5 -26.1 23.36 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.203 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.2 -40.43 18.13 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 0.0 109.454 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.778 HG22 ' O ' ' B' ' 52' ' ' VAL . 21.0 m -59.83 -45.69 94.56 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 O-C-N 121.205 -0.934 . . . . 0.0 109.606 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -43.06 -27.36 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.969 -1.082 . . . . 0.0 109.258 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' B' ' 56' ' ' VAL . 4.1 mt-10 -83.25 -43.33 16.18 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.302 -0.874 . . . . 0.0 108.793 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.893 HG21 ' SD ' ' B' ' 79' ' ' MET . 38.1 m -75.46 -65.82 0.85 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.694 HD13 ' HB2' ' B' ' 76' ' ' PHE . 5.9 mt -41.03 -55.61 2.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.467 -0.771 . . . . 0.0 109.221 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.05 109.56 20.6 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.263 -0.898 . . . . 0.0 109.521 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.423 ' OD1' ' NE2' ' B' ' 71' ' ' GLN . 0.9 OUTLIER -111.74 3.33 17.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' B' ' 64' ' ' GLY . 3.8 p30 -98.28 -45.83 6.03 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.516 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 102.06 95.13 2.26 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 57.5 t0 177.5 -32.86 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -1.134 . . . . 0.0 108.583 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.25 -21.62 24.1 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.48 ' HB3' ' HE3' ' B' ' 26' ' ' LYS . 26.0 mt-10 -75.82 106.71 7.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -1.134 . . . . 0.0 109.406 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.584 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -69.68 124.03 22.9 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.237 -0.914 . . . . 0.0 109.437 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -92.14 171.0 9.38 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.389 -0.82 . . . . 0.0 109.112 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.411 ' CE2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.43 -50.62 67.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.929 -1.107 . . . . 0.0 109.871 -179.941 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.455 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -49.21 -29.96 6.36 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.328 -0.857 . . . . 0.0 109.635 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.655 ' CD ' HD21 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -79.13 -34.05 43.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.124 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.989 ' CZ ' HD11 ' A' ' 3' ' ' LEU . 26.8 t80 -61.2 -55.88 27.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.059 -1.026 . . . . 0.0 108.993 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.505 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -62.39 -39.06 92.01 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.385 -0.822 . . . . 0.0 108.818 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -67.75 -18.9 65.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.333 -0.854 . . . . 0.0 108.819 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.853 ' CE2' HG23 ' B' ' 77' ' ' VAL . 0.0 OUTLIER -71.72 -67.46 0.53 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.415 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 1.077 HG21 HD12 ' A' ' 3' ' ' LEU . 41.4 t -56.94 -31.77 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.493 -0.754 . . . . 0.0 109.608 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.872 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -66.55 -38.86 88.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.894 . . . . 0.0 110.147 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.893 ' SD ' HG21 ' B' ' 59' ' ' THR . 9.4 mtp -78.35 -71.52 0.42 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.007 -1.058 . . . . 0.0 109.527 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.655 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -43.36 -25.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.848 0 O-C-N 120.445 -1.409 . . . . 0.0 109.654 -179.562 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.481 ' N ' ' O ' ' B' ' 79' ' ' MET . 8.8 m -78.1 -68.79 0.6 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.963 -1.086 . . . . 0.0 108.612 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.6 t -79.32 -49.96 11.62 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.0 108.628 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.62 -41.2 0.67 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.334 0.588 . . . . 0.0 109.602 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 1.7 t -89.3 -33.48 16.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 0.0 109.551 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' B' ' 81' ' ' THR . 3.2 t-160 -61.28 -15.41 34.92 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.431 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.3 -40.84 64.2 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.242 -0.911 . . . . 0.0 109.469 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 t80 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.488 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 4' ' ' GLU . 57.6 m . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.642 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.1 OUTLIER -58.92 -71.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 109.824 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.065 HD21 HG21 ' B' ' 13' ' ' VAL . 3.2 mm? -73.23 -35.29 66.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.112 -0.992 . . . . 0.0 109.836 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 1' ' ' SER . 19.6 tp10 -55.71 -63.16 1.26 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 109.505 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.51 -47.24 86.49 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -64.49 -11.15 30.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.277 -0.889 . . . . 0.0 109.452 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 60.5 ttp -85.4 -41.24 15.61 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.465 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 11' ' ' ILE . 85.5 t -70.79 -29.79 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.988 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -78.93 -54.72 5.76 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.715 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -55.92 -46.16 78.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.532 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.596 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -59.2 -46.17 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.183 -0.948 . . . . 0.0 109.308 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.596 ' N ' HG23 ' A' ' 11' ' ' ILE . 2.7 t0 -59.01 -22.94 61.47 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.174 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 35' ' ' LEU . 2.3 t -82.79 -27.4 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.189 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 22.4 t80 -69.9 -46.64 64.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.973 -1.079 . . . . 0.0 109.45 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -34.79 49.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.649 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.87 -63.32 1.08 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.248 -0.907 . . . . 0.0 109.597 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.598 ' CD1' HG13 ' A' ' 13' ' ' VAL . 37.5 m-85 -59.14 -51.92 67.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.305 -0.872 . . . . 0.0 109.623 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.48 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 13.9 m -62.41 -12.7 23.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.215 -0.928 . . . . 0.0 109.505 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.489 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -82.83 10.67 56.43 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 -39.4 17.37 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -1.17 . . . . 0.0 109.465 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.499 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 2.6 tt0 -84.15 82.1 8.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 109.467 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.49 -132.93 12.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.475 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 1.7 m-20 -64.03 -91.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -1.142 . . . . 0.0 109.484 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.489 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 176.54 132.33 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.428 ' C ' ' HG3' ' A' ' 26' ' ' LYS . 15.3 p-80 -170.03 -53.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.149 -0.969 . . . . 0.0 109.835 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.541 ' CE ' ' HB3' ' A' ' 67' ' ' GLU . 50.4 mtmt -148.74 170.19 18.76 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.128 -0.982 . . . . 0.0 109.843 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.846 HD23 ' C ' ' A' ' 31' ' ' GLU . 5.2 mp -94.35 152.16 18.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.282 -0.887 . . . . 0.0 109.806 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.499 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -116.65 69.25 0.75 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.111 -0.993 . . . . 0.0 109.324 179.585 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HG3' ' A' ' 57' ' ' MET . 0.0 OUTLIER 62.71 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.625 -0.672 . . . . 0.0 110.639 179.352 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.5 p -50.64 -29.94 12.28 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.7 -1.25 . . . . 0.0 109.799 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.846 ' C ' HD23 ' A' ' 27' ' ' LEU . 9.6 mt-10 -66.2 -42.54 88.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.04 -1.038 . . . . 0.0 108.274 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.928 HD23 ' CE1' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -54.12 -60.74 2.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.083 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.833 ' HD2' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.71 -53.07 4.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.798 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.36 -51.2 11.51 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.238 -0.913 . . . . 0.0 109.705 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.993 HD23 ' HG3' ' A' ' 39' ' ' GLU . 0.3 OUTLIER -57.35 -55.61 32.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.329 -0.857 . . . . 0.0 109.925 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.811 HD13 HG11 ' A' ' 80' ' ' VAL . 68.0 mt -64.61 -9.36 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.188 -0.945 . . . . 0.0 109.966 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 9.2 m120 -91.31 -74.43 0.5 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.076 -1.015 . . . . 0.0 109.563 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -62.02 -12.44 18.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.689 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.993 ' HG3' HD23 ' A' ' 35' ' ' LEU . 6.1 mm-40 -110.83 -44.47 3.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.162 -0.961 . . . . 0.0 109.698 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 1.9 mt -108.4 64.94 0.62 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.128 -0.983 . . . . 0.0 109.472 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.328 -0.857 . . . . 0.0 109.558 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.74 HG21 HG12 ' A' ' 53' ' ' VAL . 2.5 mm . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -67.65 0.23 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.285 -0.885 . . . . 0.0 109.253 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 1.9 tt0 -139.45 42.2 2.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 109.238 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.767 ' HA ' HG12 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 68.62 56.5 0.45 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.311 -0.868 . . . . 0.0 109.34 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -88.64 -70.35 0.65 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -0.933 . . . . 0.0 109.543 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.862 ' O ' HG13 ' A' ' 56' ' ' VAL . 5.4 t -88.0 -23.36 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.13 -0.981 . . . . 0.0 109.289 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.833 HG11 ' HD2' ' A' ' 33' ' ' LYS . 2.8 p -72.5 -32.05 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.012 -1.055 . . . . 0.0 108.731 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.458 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 23.0 t0 -90.37 -37.21 14.15 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.465 -0.772 . . . . 0.0 109.139 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 1.1 ttmt -68.43 -31.82 71.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.335 -0.853 . . . . 0.0 109.427 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.985 ' HB ' HD13 ' A' ' 60' ' ' LEU . 3.7 m -57.99 -49.69 80.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 O-C-N 121.224 -0.923 . . . . 0.0 109.703 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.486 ' HG3' ' HG2' ' A' ' 29' ' ' LYS . 3.0 mmt -43.45 -26.88 0.23 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.807 -1.183 . . . . 0.0 109.496 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -78.37 -45.83 21.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.293 -0.879 . . . . 0.0 108.967 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 15.5 m -86.63 -62.16 1.57 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 109.382 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.985 HD13 ' HB ' ' A' ' 56' ' ' VAL . 4.7 mp -40.1 -28.25 0.05 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.412 -0.805 . . . . 0.0 109.981 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' MET . 8.9 p-10 -48.75 113.21 0.73 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.113 -0.992 . . . . 0.0 109.405 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -78.96 -49.97 11.9 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.209 -0.932 . . . . 0.0 109.503 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.11 -13.79 7.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.225 -0.922 . . . . 0.0 109.822 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 100.26 102.94 2.51 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HB3' ' OE1' ' A' ' 67' ' ' GLU . 0.4 OUTLIER 167.31 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -1.111 . . . . 0.0 108.519 -179.757 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.56 -20.23 25.33 Favored Glycine 0 N--CA 1.485 1.911 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB3' ' CE ' ' A' ' 26' ' ' LYS . 6.8 mt-10 -69.9 103.28 2.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -1.146 . . . . 0.0 109.133 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.537 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.94 124.11 23.21 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.263 -0.898 . . . . 0.0 109.754 -179.36 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 29.9 t0 -94.21 170.46 9.5 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.552 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.3 OUTLIER -53.96 -51.62 63.29 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 110.214 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 3.4 mt-30 -51.48 -34.66 36.63 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.21 -0.931 . . . . 0.0 109.453 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.671 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.13 -27.74 42.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.164 -0.96 . . . . 0.0 109.8 -179.73 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.715 ' CE2' HD23 ' A' ' 10' ' ' LEU . 19.5 t80 -62.47 -49.74 74.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.001 -1.062 . . . . 0.0 108.571 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -63.15 -41.67 99.31 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.037 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.51 ' HA ' ' SD ' ' B' ' 74' ' ' MET . . . -72.4 -12.07 60.96 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.928 ' CE1' HD23 ' A' ' 32' ' ' LEU . 6.7 t80 -71.58 -70.05 0.35 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 ' HG ' ' B' ' 3' ' ' LEU . 44.1 t -69.22 -25.46 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.143 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.576 ' CB ' ' HB3' ' B' ' 74' ' ' MET . . . -69.12 -34.49 75.13 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.472 -0.768 . . . . 0.0 109.527 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.722 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -79.12 -70.73 0.48 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.178 -0.951 . . . . 0.0 108.876 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.811 HG11 HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.46 -24.36 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 O-C-N 120.593 -1.317 . . . . 0.0 109.512 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.465 ' N ' ' O ' ' A' ' 79' ' ' MET . 8.2 m -78.56 -69.02 0.59 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 0.0 108.599 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.5 t -79.09 -50.1 11.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.944 . . . . 0.0 108.659 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.46 -40.41 0.56 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.329 0.585 . . . . 0.0 109.619 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.08 -31.97 16.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.516 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -64.64 -11.34 34.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 83' ' ' ALA . 11.8 pt-20 -65.4 -13.71 59.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.231 -0.918 . . . . 0.0 109.466 179.986 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.486 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 14.9 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.988 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -53.54 -60.44 3.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.254 -0.903 . . . . 0.0 109.588 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.971 ' HG ' HG21 ' A' ' 77' ' ' VAL . 3.6 mm? -69.51 -18.36 63.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.22 -0.925 . . . . 0.0 109.54 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' B' ' 1' ' ' SER . 0.6 OUTLIER -64.44 -63.4 1.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.383 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.91 -42.69 94.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.325 -0.859 . . . . 0.0 109.41 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.51 -23.13 67.17 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.237 -0.914 . . . . 0.0 109.509 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.475 ' O ' HG12 ' B' ' 11' ' ' ILE . 2.6 ttp -81.97 -29.75 32.01 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.57 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.43 HG23 ' O ' ' B' ' 4' ' ' GLU . 47.1 t -72.52 -35.81 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.642 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -74.62 -52.23 12.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 109.499 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.98 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -57.33 -45.96 83.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.207 -0.933 . . . . 0.0 109.485 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.856 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 15.1 mm -55.07 -49.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.97 -20.54 66.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 1.065 HG21 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -76.33 -39.06 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 0.0 109.38 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 25.0 t80 -67.87 -46.4 71.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.956 -1.09 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.471 ' O ' ' HB2' ' B' ' 18' ' ' SER . 4.8 m80 -64.92 -54.59 28.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 0.0 109.66 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -56.14 -65.09 0.66 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.206 -0.934 . . . . 0.0 109.501 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.673 ' CZ ' HD12 ' B' ' 35' ' ' LEU . 39.1 m-85 -53.1 -20.39 3.68 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.282 -0.886 . . . . 0.0 109.474 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' B' ' 15' ' ' HIS . 0.5 OUTLIER -71.88 -50.63 27.66 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.722 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 19' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' B' ' 23' ' ' ASP . . . -90.5 53.78 3.45 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 15.0 mmm180 -90.2 -46.91 8.13 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -1.167 . . . . 0.0 109.603 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -139.1 81.47 1.84 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.177 -0.952 . . . . 0.0 109.85 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 85.5 -93.0 1.8 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' B' ' 18' ' ' SER . 16.2 m-20 -42.18 150.34 0.13 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.372 -1.075 . . . . 0.0 109.736 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' B' ' 24' ' ' LYS . 1.9 tmmt? -144.12 58.56 1.35 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 33.8 t60 -170.23 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 109.479 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -122.54 169.98 10.46 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 109.38 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.518 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 28.8 mt -119.34 127.81 53.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.947 . . . . 0.0 110.325 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -74.53 153.37 39.1 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.375 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.524 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 16.4 ttmt -36.86 -31.33 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.425 -0.797 . . . . 0.0 109.728 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 28' ' ' LYS . 2.8 t -72.35 -52.36 16.48 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.335 -0.853 . . . . 0.0 109.314 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -49.0 -44.95 41.71 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.115 -0.991 . . . . 0.0 108.553 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.52 HD21 ' CB ' ' B' ' 68' ' ' CYS . 28.7 mt -51.87 -67.13 0.28 Allowed 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.63 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.01 -28.92 0.09 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.416 -0.803 . . . . 0.0 109.789 179.861 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -70.06 -60.07 2.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.176 -0.952 . . . . 0.0 109.411 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.892 HD21 ' CE1' ' B' ' 73' ' ' PHE . 11.9 tp -45.36 -48.44 13.33 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 0.0 109.654 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.89 HD13 HG11 ' B' ' 80' ' ' VAL . 31.1 mt -66.49 -34.64 71.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.213 -0.929 . . . . 0.0 109.562 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.473 ' OD1' HD11 ' B' ' 47' ' ' ILE . 3.7 m120 -86.14 7.15 26.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -0.903 . . . . 0.0 109.597 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.512 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 4.4 m-80 -105.21 -46.85 4.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.687 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.526 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 40.6 mp0 -124.9 -10.43 7.19 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.795 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.699 HD21 HG23 ' B' ' 81' ' ' THR . 0.1 OUTLIER -102.47 -4.49 25.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 0.0 109.55 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.971 . . . . 0.0 109.483 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.739 HG22 ' O ' ' B' ' 49' ' ' GLU . 35.0 mm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 36.19 44.68 0.29 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.671 -0.643 . . . . 0.0 109.846 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.739 ' O ' HG22 ' B' ' 47' ' ' ILE . 1.6 pt-20 86.54 -172.47 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.528 ' CG ' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -85.07 63.92 8.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.012 -1.055 . . . . 0.0 109.539 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.422 ' HB3' ' HE2' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -90.64 -70.45 0.68 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.152 -179.731 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.866 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.5 t -88.64 -25.0 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.102 -0.999 . . . . 0.0 109.623 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.63 HG11 ' CG ' ' B' ' 33' ' ' LYS . 2.5 t -72.46 -29.62 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 O-C-N 120.983 -1.073 . . . . 0.0 108.228 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.452 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.79 -42.13 10.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.0 109.123 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -33.56 76.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.349 -0.844 . . . . 0.0 109.589 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.939 ' HB ' HD13 ' B' ' 60' ' ' LEU . 2.9 m -52.55 -55.25 11.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.593 ' H ' HG23 ' B' ' 56' ' ' VAL . 2.5 tpt -40.17 -34.28 0.3 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.072 -1.017 . . . . 0.0 109.692 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.23 -56.83 10.58 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.257 -0.902 . . . . 0.0 108.772 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.719 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.9 m -76.53 -65.5 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.356 -0.84 . . . . 0.0 108.864 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 1.046 HD21 ' CG ' ' B' ' 76' ' ' PHE . 4.6 mp -32.44 -38.1 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.308 0.575 . . . . 0.0 110.258 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 59' ' ' THR . 37.9 t0 -84.92 71.43 10.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.907 . . . . 0.0 109.507 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -86.99 -10.42 53.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 109.429 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.51 -41.64 9.24 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.23 -0.919 . . . . 0.0 109.444 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.74 89.58 1.96 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 175.54 -31.97 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.313 -1.11 . . . . 0.0 108.662 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.09 -32.18 6.89 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 3.6 mm-40 -69.93 126.82 30.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.339 -1.094 . . . . 0.0 109.31 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.575 ' CA ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -78.47 130.57 36.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.087 -1.008 . . . . 0.0 109.561 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -105.26 170.39 7.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.269 -0.894 . . . . 0.0 109.286 179.708 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.856 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 0.9 OUTLIER -49.4 -55.98 11.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.99 -1.069 . . . . 0.0 110.511 -179.742 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.588 ' O ' ' HE3' ' B' ' 74' ' ' MET . 2.3 mt-30 -50.82 -32.63 20.71 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.177 -0.952 . . . . 0.0 109.73 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.887 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -75.78 -32.71 60.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.948 -1.095 . . . . 0.0 109.543 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.98 ' CE2' HD23 ' B' ' 10' ' ' LEU . 3.0 t80 -62.66 -53.58 52.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.174 -0.954 . . . . 0.0 108.91 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.588 ' HE3' ' O ' ' B' ' 71' ' ' GLN . 0.0 OUTLIER -55.28 -46.96 76.15 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.541 -0.725 . . . . 0.0 109.795 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.986 ' HB1' ' CE ' ' B' ' 79' ' ' MET . . . -75.16 -14.28 60.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.075 -1.016 . . . . 0.0 109.195 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 1.046 ' CG ' HD21 ' B' ' 60' ' ' LEU . 1.9 t80 -71.83 -70.24 0.34 Allowed 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.396 -0.815 . . . . 0.0 109.317 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.47 -46.14 93.1 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.589 -0.694 . . . . 0.0 109.609 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.782 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -51.99 -41.41 62.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.439 -0.788 . . . . 0.0 110.551 -179.436 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.986 ' CE ' ' HB1' ' B' ' 75' ' ' ALA . 12.6 mtm -69.83 -69.68 0.33 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.76 -1.213 . . . . 0.0 109.059 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.89 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -42.49 -23.96 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 120.867 -1.146 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.699 HG23 HD21 ' B' ' 40' ' ' LEU . 0.6 OUTLIER -77.54 -68.77 0.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.832 -1.168 . . . . 0.0 108.899 178.861 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -78.18 -49.95 12.86 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.138 -0.976 . . . . 0.0 108.367 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.77 -43.25 0.42 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.235 0.54 . . . . 0.0 109.846 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.466 ' SG ' ' HE3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -90.17 -31.94 16.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.532 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -50.99 -34.59 29.68 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.285 -0.885 . . . . 0.0 109.584 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -46.67 -45.89 19.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.241 -0.912 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.553 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.5 tp10 -64.58 -77.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.544 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.758 HD13 HG21 ' B' ' 13' ' ' VAL . 7.2 mp -71.5 -30.17 65.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -56.32 -57.64 11.41 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.0 109.459 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -62.03 -40.15 94.74 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.464 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.639 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -66.45 -17.06 64.58 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.464 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.524 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 36.3 ttp -84.46 -36.19 22.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.891 . . . . 0.0 109.514 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 t -68.03 -42.0 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.948 . . . . 0.0 109.522 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -77.32 -59.78 2.64 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.525 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 85.4 mt -47.77 -48.71 30.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.555 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.75 HD13 ' CZ ' ' A' ' 70' ' ' PHE . 23.6 mm -57.78 -48.14 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 3.1 t0 -62.98 -19.65 64.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.916 . . . . 0.0 109.554 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.827 HG21 ' CD1' ' B' ' 3' ' ' LEU . 2.4 t -80.65 -29.72 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.301 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 18' ' ' SER . 15.1 t80 -73.73 -45.07 54.34 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.003 -1.061 . . . . 0.0 109.295 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.546 ' CE1' ' HD3' ' A' ' 24' ' ' LYS . 4.9 t60 -78.79 -29.36 44.93 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.301 -0.875 . . . . 0.0 109.617 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.6 tt0 -75.8 -62.25 1.65 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.494 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CD1' HG13 ' A' ' 13' ' ' VAL . 27.9 m-85 -55.82 -48.09 76.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 14' ' ' PHE . 1.2 t -67.62 -20.04 65.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.923 . . . . 0.0 109.427 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.469 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -89.75 17.61 51.74 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -88.61 -57.53 2.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -1.166 . . . . 0.0 109.448 -179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -113.53 140.4 48.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.221 -0.924 . . . . 0.0 109.449 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.24 -119.11 4.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.491 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 4.2 m-20 -122.25 -80.67 0.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.224 -1.162 . . . . 0.0 109.463 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HD3' ' CE1' ' A' ' 15' ' ' HIS . 0.0 OUTLIER 165.51 99.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.499 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.546 ' CG ' ' O ' ' A' ' 24' ' ' LYS . 24.5 m80 -164.24 -41.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.542 ' CD ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -142.35 170.31 15.94 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.241 -0.912 . . . . 0.0 109.446 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.709 HD22 ' HB3' ' A' ' 31' ' ' GLU . 75.1 mt -112.01 134.26 53.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.92 . . . . 0.0 109.823 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 29' ' ' LYS . 3.6 mttt -81.79 165.16 21.14 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 28' ' ' LYS . 11.1 ptpt -45.0 -26.29 0.41 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.11 -0.994 . . . . 0.0 109.141 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 28' ' ' LYS . 4.9 p -82.43 -42.94 17.92 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.3 -0.875 . . . . 0.0 110.039 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HB3' HD22 ' A' ' 27' ' ' LEU . 36.4 mm-40 -56.84 -42.91 80.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.972 -1.08 . . . . 0.0 108.666 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.839 HD21 ' SG ' ' A' ' 68' ' ' CYS . 29.8 mt -62.66 -62.74 1.53 Allowed 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.886 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.62 -28.44 0.07 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.415 -0.803 . . . . 0.0 109.677 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -70.97 -58.36 3.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.441 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.852 HD22 HD21 ' B' ' 3' ' ' LEU . 12.6 mt -51.88 -39.58 59.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.278 -0.888 . . . . 0.0 109.736 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.753 HD12 HG22 ' A' ' 53' ' ' VAL . 0.9 OUTLIER -74.26 -29.17 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -88.77 -3.14 58.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.93 . . . . 0.0 109.599 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -102.33 -45.91 4.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.188 -0.945 . . . . 0.0 109.512 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.515 ' HG3' ' N ' ' B' ' 4' ' ' GLU . 0.6 OUTLIER -106.14 -18.32 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.721 HD22 ' HB ' ' A' ' 80' ' ' VAL . 0.4 OUTLIER -115.12 72.48 0.8 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.391 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 109.502 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.828 HG13 HG21 ' A' ' 53' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 47' ' ' ILE . 8.9 pttt 173.81 -49.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.97 . . . . 0.0 109.24 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.425 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -131.5 21.19 4.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.371 -0.831 . . . . 0.0 109.062 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mp0 65.48 59.62 0.78 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 0.0 109.32 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.7 -70.36 0.67 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.254 -0.904 . . . . 0.0 109.522 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.785 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.5 t -86.2 -21.13 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.313 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.886 HG11 ' HG3' ' A' ' 33' ' ' LYS . 89.8 t -76.63 -28.37 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.036 . . . . 0.0 109.114 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 28.9 t0 -90.16 -34.88 15.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.289 -0.882 . . . . 0.0 109.448 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -40.81 62.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.216 -0.928 . . . . 0.0 109.692 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.785 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.9 m -62.65 -49.44 83.75 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.075 -1.015 . . . . 0.0 109.622 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.616 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 13.2 tpp -41.98 -25.94 0.08 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.725 -1.234 . . . . 0.0 109.49 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.4 tm-20 -79.72 -50.95 9.84 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.071 -1.018 . . . . 0.0 109.935 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.566 ' CG2' ' N ' ' A' ' 60' ' ' LEU . 2.3 t -77.7 -52.88 8.25 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.899 -1.126 . . . . 0.0 109.782 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.611 HD22 ' HB2' ' A' ' 76' ' ' PHE . 20.4 mt -40.54 -52.67 2.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -71.96 113.28 8.83 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.376 -0.828 . . . . 0.0 109.557 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -110.26 25.73 11.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.335 -0.853 . . . . 0.0 109.38 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.0 -37.01 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.262 -0.898 . . . . 0.0 109.461 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 91.42 73.97 1.27 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.7 OUTLIER -177.39 30.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -1.154 . . . . 0.0 108.471 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.51 63.83 3.82 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.542 ' HB2' ' CD ' ' A' ' 26' ' ' LYS . 3.6 pt-20 -162.96 110.85 1.26 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.326 -1.103 . . . . 0.0 109.298 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.839 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.8 m -69.59 167.58 16.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -127.4 172.11 10.94 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.75 ' CZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.18 -62.13 2.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.648 -1.282 . . . . 0.0 110.352 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.961 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.0 pt20 -48.08 -27.08 2.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.151 -0.968 . . . . 0.0 108.845 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -74.82 -42.8 57.36 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.633 -0.667 . . . . 0.0 109.695 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.786 ' HE1' HD13 ' A' ' 35' ' ' LEU . 32.4 t80 -54.02 -46.85 71.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.317 -0.864 . . . . 0.0 109.611 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' MET . . . . . 1.075 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 1.6 tpp -63.8 -54.63 32.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 109.336 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.738 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -64.46 -10.62 26.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.241 -0.912 . . . . 0.0 109.534 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.695 ' CE1' HG21 ' A' ' 80' ' ' VAL . 0.2 OUTLIER -74.39 -64.02 1.11 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.664 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.578 ' HB ' ' HE2' ' B' ' 74' ' ' MET . 87.0 t -58.2 -23.8 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.897 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.67 -40.76 88.75 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.525 -0.734 . . . . 0.0 109.19 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.709 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -77.75 -70.95 0.44 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.271 -0.893 . . . . 0.0 109.512 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.721 ' HB ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -44.05 -24.67 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 120.502 -1.374 . . . . 0.0 110.035 -179.13 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.487 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.2 m -79.64 -66.73 0.84 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.919 -1.113 . . . . 0.0 108.433 178.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.547 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.9 m -78.4 -53.9 6.76 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.88 -44.32 0.49 Allowed 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.259 0.552 . . . . 0.0 109.782 179.156 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.02 -47.43 65.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.564 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.27 -12.06 26.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.288 -0.883 . . . . 0.0 109.518 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.02 -31.86 17.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.454 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.691 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.19 -70.74 0.11 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.0 109.791 -179.797 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.852 HD21 HD22 ' A' ' 35' ' ' LEU . 7.8 mp -74.64 -37.81 62.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.077 -1.014 . . . . 0.0 109.809 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -52.7 -62.39 1.68 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.952 . . . . 0.0 109.547 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.538 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.0 OUTLIER -60.94 -47.72 85.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.292 -0.88 . . . . 0.0 109.646 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.594 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -60.82 -13.8 17.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.239 -0.913 . . . . 0.0 109.627 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.621 ' O ' HD12 ' B' ' 11' ' ' ILE . 42.6 ttp -83.72 -49.34 9.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.51 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.538 HG12 ' O ' ' B' ' 5' ' ' LYS . 5.8 p -61.6 -34.28 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.285 -0.884 . . . . 0.0 109.648 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.553 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -73.33 -60.25 2.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.538 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.639 HD23 ' CB ' ' A' ' 6' ' ' ALA . 2.0 mm? -44.01 -49.54 8.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.42 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.621 HD12 ' O ' ' B' ' 7' ' ' MET . 13.6 mt -57.53 -47.97 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.233 -0.917 . . . . 0.0 109.548 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -51.34 -27.71 10.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.923 . . . . 0.0 109.474 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.846 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -84.79 -33.18 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.511 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 5.2 t80 -61.2 -49.11 78.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.882 -1.136 . . . . 0.0 109.471 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -78.06 -37.57 46.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.281 -0.887 . . . . 0.0 109.738 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 1.4 tp60 -60.07 -67.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.556 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.555 ' CD1' HG13 ' B' ' 13' ' ' VAL . 53.0 m-85 -57.99 -54.11 50.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 6.4 m -62.82 -12.7 26.28 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.0 109.589 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.88 -21.33 26.12 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.439 ' HB3' ' OE2' ' B' ' 21' ' ' GLU . 5.0 mmt180 -54.95 -47.04 75.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -1.117 . . . . 0.0 109.501 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.439 ' OE2' ' HB3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -168.83 147.98 4.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.491 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.77 -111.24 2.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.448 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -107.98 -78.76 0.58 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.204 -1.174 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER 168.56 -35.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 26.8 m80 -115.95 18.13 15.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.913 . . . . 0.0 109.429 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.489 ' HD2' ' HB2' ' B' ' 67' ' ' GLU . 30.5 mtmt -144.5 152.99 41.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.95 HD21 HD12 ' B' ' 35' ' ' LEU . 3.5 mp -93.59 142.77 26.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.129 -0.982 . . . . 0.0 109.739 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.589 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -98.78 86.29 3.49 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.365 -0.835 . . . . 0.0 109.099 179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 43.39 -86.18 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.43 -0.794 . . . . 0.0 110.826 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.589 ' N ' ' O ' ' B' ' 28' ' ' LYS . 39.1 t -47.82 -33.12 6.87 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.298 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.884 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.1 OUTLIER -56.25 -44.25 79.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.795 -1.19 . . . . 0.0 109.216 -179.784 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.631 HD23 HD22 ' B' ' 27' ' ' LEU . 5.2 mt -65.33 -52.82 51.32 Favored 'General case' 0 C--N 1.297 -1.712 0 O-C-N 121.479 -0.763 . . . . 0.0 109.124 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.82 ' HG2' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.89 -64.27 0.61 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.39 -0.819 . . . . 0.0 109.884 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.544 ' HG3' ' CE2' ' B' ' 17' ' ' TYR . 5.0 pt-20 -47.34 -56.37 6.99 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.128 -0.983 . . . . 0.0 109.69 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.95 HD12 HD21 ' B' ' 27' ' ' LEU . 2.8 mt -43.51 -39.04 3.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.212 -0.93 . . . . 0.0 109.771 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 1.05 HD12 HG22 ' B' ' 53' ' ' VAL . 0.5 OUTLIER -69.46 -52.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.252 -0.905 . . . . 0.0 109.529 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.596 ' ND2' HG13 ' B' ' 47' ' ' ILE . 18.4 m120 -89.11 20.79 3.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 109.786 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 13.8 t-20 -118.23 -36.12 3.65 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.973 . . . . 0.0 109.491 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 10.1 mm-40 -121.18 -14.27 8.39 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.23 -0.918 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.541 HD11 HG22 ' B' ' 77' ' ' VAL . 1.1 mt -113.25 52.97 0.77 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 -179.986 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.938 HG22 ' H ' ' B' ' 49' ' ' GLU . 26.8 mm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.588 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 88.89 8.25 0.12 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.564 -0.71 . . . . 0.0 109.495 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.938 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.1 tt0 79.68 8.69 1.62 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.47 -0.769 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -176.19 21.25 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.73 -1.231 . . . . 0.0 111.475 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 51.5 tp10 -91.02 -70.74 0.67 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.488 -1.383 . . . . 0.0 109.331 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.775 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.2 t -93.56 -19.38 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.261 -0.899 . . . . 0.0 108.666 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.05 HG22 HD12 ' B' ' 36' ' ' ILE . 4.7 t -78.91 -20.44 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.369 -0.832 . . . . 0.0 109.233 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -85.1 -37.42 20.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.437 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -40.04 30.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 109.422 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' B' ' 52' ' ' VAL . 34.1 m -63.9 -46.07 95.18 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 O-C-N 121.211 -0.931 . . . . 0.0 109.62 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 4.9 tpt -41.87 -27.46 0.12 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.06 -1.025 . . . . 0.0 109.591 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.2 OUTLIER -84.5 -42.84 15.15 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.235 -0.916 . . . . 0.0 108.913 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.451 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.8 m -75.92 -63.99 1.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.353 -0.842 . . . . 0.0 109.753 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.69 HD22 ' HB2' ' B' ' 76' ' ' PHE . 3.8 mt -41.24 -39.43 1.35 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD2' ' HE2' ' B' ' 57' ' ' MET . 50.2 m-20 -90.22 111.87 23.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.283 -0.885 . . . . 0.0 109.431 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' B' ' 72' ' ' GLU . 11.3 p-10 -95.99 -13.59 23.68 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.188 -0.945 . . . . 0.0 109.63 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' ASP . . . . . 0.409 ' HB3' ' OE2' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -105.73 -22.01 13.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.612 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' B' ' 65' ' ' ASP . . . 80.68 99.82 0.33 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' ASP . . . . . 0.495 ' CB ' ' O ' ' B' ' 64' ' ' GLY . 0.5 OUTLIER 164.87 -26.16 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.25 -1.147 . . . . 0.0 108.608 -179.787 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 66' ' ' GLY . . . . . 0.466 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.56 23.44 5.97 Favored Glycine 0 N--CA 1.484 1.874 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' B' ' 67' ' ' GLU . 3.3 pt-20 -110.49 86.27 2.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.366 -1.079 . . . . 0.0 109.316 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 13.1 t -69.9 156.24 39.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.214 -0.929 . . . . 0.0 109.78 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.3 OUTLIER -118.71 171.42 8.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.438 -0.789 . . . . 0.0 108.996 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.45 -51.57 67.92 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.228 -0.92 . . . . 0.0 110.335 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.589 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 16.7 pt20 -57.39 -37.97 73.52 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.411 -0.805 . . . . 0.0 109.222 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.498 ' HG2' ' HG3' ' B' ' 71' ' ' GLN . 1.8 mt-10 -79.3 -15.72 57.51 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.445 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.596 ' CE2' HD12 ' B' ' 10' ' ' LEU . 5.8 t80 -71.05 -63.41 1.11 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 108.708 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.897 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -60.56 -37.78 82.39 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.426 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.844 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -59.58 -37.35 78.29 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.874 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.0 OUTLIER -57.59 -67.39 0.34 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.813 HG23 ' CE2' ' B' ' 76' ' ' PHE . 49.4 t -52.9 -21.95 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 1.075 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -57.42 -58.0 10.18 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.482 -0.761 . . . . 0.0 108.953 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.701 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 27.0 mmm -70.82 -65.56 0.72 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.433 -0.792 . . . . 0.0 109.284 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.874 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -41.5 -25.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.655 -1.278 . . . . 0.0 110.12 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 11' ' ' ILE . 5.3 m -75.75 -70.13 0.45 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.886 -1.134 . . . . 0.0 108.673 178.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -79.11 -49.53 12.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.0 108.327 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.94 -44.0 0.75 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.249 0.547 . . . . 0.0 109.789 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.22 -27.92 19.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.268 -0.895 . . . . 0.0 109.702 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.466 ' HB3' ' HA ' ' B' ' 82' ' ' THR . 81.4 t60 -70.81 -9.34 57.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 109.727 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -9.56 55.88 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.214 -0.929 . . . . 0.0 109.724 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.0 109.808 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.866 ' OE2' HG23 ' B' ' 13' ' ' VAL . 3.7 tt0 -62.03 -71.47 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -0.933 . . . . 0.0 109.493 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.964 HD13 HG21 ' B' ' 13' ' ' VAL . 7.4 mp -71.98 -33.99 68.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.555 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.13 -61.7 2.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.219 -0.926 . . . . 0.0 109.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -61.56 -47.19 86.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.964 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -59.79 -15.28 19.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.279 -0.888 . . . . 0.0 109.375 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.768 ' HE3' HD11 ' B' ' 40' ' ' LEU . 2.9 tpp -82.25 -63.77 1.31 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.213 -0.929 . . . . 0.0 109.539 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.414 ' C ' ' O ' ' A' ' 7' ' ' MET . 19.1 t -44.27 -44.92 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.145 -0.972 . . . . 0.0 109.633 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.687 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -67.15 -60.14 2.86 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.964 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.5 mt -47.66 -70.26 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.212 -0.93 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.695 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 40.5 mt -41.65 -36.95 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.418 -0.801 . . . . 0.0 110.025 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.517 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 2.8 m-20 -60.6 -48.88 79.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.159 -0.963 . . . . 0.0 110.044 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.479 HG21 HD21 ' B' ' 3' ' ' LEU . 1.1 t -62.85 -28.55 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.4 t80 -67.51 -41.97 83.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.9 -1.125 . . . . 0.0 109.601 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -73.43 -34.35 65.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.29 -0.881 . . . . 0.0 110.019 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.517 ' CG ' ' O ' ' A' ' 12' ' ' ASP . 2.1 mt-30 -69.4 -63.31 1.09 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.062 -1.024 . . . . 0.0 109.678 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.783 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 11.5 m-85 -49.88 -44.42 49.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.377 -0.827 . . . . 0.0 109.908 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -65.2 -32.84 74.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.146 -0.971 . . . . 0.0 109.52 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.21 -13.97 30.74 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.535 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 10.0 mtp85 -81.65 -32.84 31.69 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 109.527 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.47 ' OE1' ' HB2' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -79.42 134.01 36.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.286 -0.884 . . . . 0.0 109.434 179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.43 -24.91 1.81 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.47 ' HB2' ' OE1' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -72.11 -46.52 56.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.239 -1.153 . . . . 0.0 109.487 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 18' ' ' SER . 1.2 mttm 66.94 60.33 0.53 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.92 . . . . 0.0 109.43 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.439 ' HB3' ' HD3' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -170.23 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.217 -0.927 . . . . 0.0 109.759 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -142.65 169.93 16.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.158 -0.964 . . . . 0.0 109.783 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.883 HD22 ' HB3' ' A' ' 31' ' ' GLU . 22.0 mt -97.55 163.12 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.29 -0.881 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -126.97 69.95 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.128 -0.983 . . . . 0.0 109.936 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 32' ' ' LEU . 16.5 tptm 63.85 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.468 -0.77 . . . . 0.0 110.695 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.6 p -46.23 -41.42 12.85 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.146 -0.971 . . . . 0.0 110.273 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.883 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -62.28 -39.96 94.68 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.971 -1.08 . . . . 0.0 108.845 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 76' ' ' PHE . 70.0 mt -58.21 -71.05 0.12 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.777 -0.577 . . . . 0.0 109.459 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.706 ' CD ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -43.89 -39.12 3.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.249 -0.907 . . . . 0.0 109.39 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -59.54 4.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.209 -0.932 . . . . 0.0 109.218 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.783 HD12 ' CZ ' ' A' ' 17' ' ' TYR . 13.4 tp -57.23 -55.54 33.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.418 -0.801 . . . . 0.0 109.404 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.916 HD11 ' CE1' ' A' ' 76' ' ' PHE . 2.2 mt -43.65 -29.0 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.36 -0.838 . . . . 0.0 109.254 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 13.7 m120 -82.92 -40.63 19.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.251 -0.906 . . . . 0.0 109.812 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -95.31 21.22 8.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.187 -0.946 . . . . 0.0 109.777 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.985 ' HG3' HD12 ' A' ' 40' ' ' LEU . 22.8 pt-20 -129.52 -45.95 1.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.114 -0.992 . . . . 0.0 109.721 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.985 HD12 ' HG3' ' A' ' 39' ' ' GLU . 3.5 mp -76.67 -17.26 59.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.127 -0.983 . . . . 0.0 109.604 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.494 1.741 0 O-C-N 121.443 -0.786 . . . . 0.0 110.724 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.768 HG21 ' HA ' ' A' ' 50' ' ' GLN . 4.0 mt . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -44.69 -26.43 0.38 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.238 -0.914 . . . . 0.0 109.257 179.79 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER 172.96 49.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.314 -0.866 . . . . 0.0 109.271 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.768 ' HA ' HG21 ' A' ' 47' ' ' ILE . 4.1 mp0 44.15 48.38 7.62 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.23 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -90.12 -53.55 4.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.912 -179.667 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.997 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.0 t -96.05 -20.21 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.129 -0.982 . . . . 0.0 110.041 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.702 HG21 ' CE ' ' A' ' 33' ' ' LYS . 37.1 t -81.5 -30.33 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.772 -1.205 . . . . 0.0 108.698 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -90.01 -24.4 21.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.405 -0.809 . . . . 0.0 108.848 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.8 OUTLIER -82.59 -48.42 11.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.38 -0.825 . . . . 0.0 109.208 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.792 HG21 ' CE1' ' A' ' 76' ' ' PHE . 33.0 m -57.6 -44.77 85.89 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 O-C-N 121.158 -0.964 . . . . 0.0 109.26 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.584 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -37.39 -30.87 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.483 -0.761 . . . . 0.0 109.632 -179.801 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.36 -44.99 12.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.937 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 56' ' ' VAL . 15.8 m -63.9 -65.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.831 HD13 ' CE2' ' A' ' 76' ' ' PHE . 3.3 mt -40.15 -66.76 0.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.444 -0.785 . . . . 0.0 109.602 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.412 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -45.76 94.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.45 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 60' ' ' LEU . 2.1 m-20 -109.62 -5.14 15.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.555 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -100.61 -39.79 7.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.206 -0.934 . . . . 0.0 109.383 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 68.92 0.83 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -168.76 25.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -1.153 . . . . 0.0 108.6 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.412 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 49.11 27.63 7.27 Favored Glycine 0 N--CA 1.482 1.705 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.464 ' OE1' ' HG3' ' A' ' 26' ' ' LYS . 51.0 mm-40 -124.27 133.54 53.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.255 -1.144 . . . . 0.0 109.543 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 15.7 t -78.02 158.95 29.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.275 -0.891 . . . . 0.0 109.614 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.4 OUTLIER -127.21 171.63 11.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 108.877 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.695 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -58.61 -54.02 51.77 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.293 -0.88 . . . . 0.0 110.488 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.435 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 1.2 pm0 -56.21 -29.71 61.31 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.093 -1.005 . . . . 0.0 108.887 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 6.8 mt-10 -80.13 -25.41 39.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 109.513 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.498 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 8.3 t80 -67.63 -55.65 12.46 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.307 -0.871 . . . . 0.0 108.83 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.539 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 8.9 mtt -61.34 -37.74 84.41 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.526 ' O ' ' CG ' ' A' ' 79' ' ' MET . . . -71.67 -19.9 62.02 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.47 -0.769 . . . . 0.0 109.018 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -72.96 -69.56 0.41 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.792 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.914 HG22 ' CD ' ' A' ' 39' ' ' GLU . 42.0 t -54.61 -38.81 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.241 -0.912 . . . . 0.0 109.647 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.7 ' HB1' ' HB3' ' B' ' 74' ' ' MET . . . -65.76 -29.53 70.05 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.309 -0.869 . . . . 0.0 109.924 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.9 mmm -82.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.045 -1.034 . . . . 0.0 109.57 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.997 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.75 -20.81 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 O-C-N 120.399 -1.438 . . . . 0.0 109.709 -179.085 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.575 HG23 ' N ' ' A' ' 82' ' ' THR . 4.8 t -87.81 -50.93 6.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.795 -1.191 . . . . 0.0 109.371 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.586 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.2 t -90.32 -51.46 5.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.867 -1.145 . . . . 0.0 107.973 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.45 -37.04 0.08 Allowed 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.275 0.559 . . . . 0.0 109.946 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' A' ' 82' ' ' THR . 3.8 t -90.02 -38.04 13.88 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' A' ' 82' ' ' THR . 28.4 t60 -55.46 -18.33 6.86 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.222 -0.924 . . . . 0.0 109.489 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.54 -41.56 81.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.516 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.0 t80 . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.225 -0.922 . . . . 0.0 109.52 -179.962 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.52 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 8.2 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.423 0.63 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 2' ' ' GLU . . . . . 0.687 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 1.6 tp10 -60.14 -63.26 1.36 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.838 . . . . 0.0 109.598 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.697 ' CD1' HD23 ' A' ' 10' ' ' LEU . 3.3 mm? -75.88 -34.83 60.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.63 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.52 ' HB2' ' N ' ' B' ' 1' ' ' SER . 2.7 mm-40 -53.45 -61.98 1.95 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.236 -0.915 . . . . 0.0 109.63 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -60.73 -48.06 83.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.23 -0.919 . . . . 0.0 109.546 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -61.11 -14.13 22.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.278 -0.889 . . . . 0.0 109.664 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.545 ' SD ' HG12 ' A' ' 77' ' ' VAL . 1.6 mmt -83.05 -64.37 1.18 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 109.6 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.433 ' H ' HG23 ' B' ' 8' ' ' VAL . 3.2 t -51.35 -25.81 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -75.89 -57.84 3.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.207 -0.933 . . . . 0.0 109.6 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 0.491 HD13 HD11 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -49.26 -39.31 30.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.215 -0.928 . . . . 0.0 109.639 -179.867 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.495 HD12 ' O ' ' B' ' 7' ' ' MET . 4.8 mt -70.46 -35.53 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.209 -0.932 . . . . 0.0 109.665 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 2.6 t70 -69.58 -16.17 63.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 0.0 109.638 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.964 HG21 HD13 ' A' ' 3' ' ' LEU . 1.5 t -89.99 -37.99 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.457 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' SG ' ' B' ' 68' ' ' CYS . 46.1 t80 -66.95 -42.08 85.86 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.866 -1.147 . . . . 0.0 109.341 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' HIS . . . . . 0.602 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -78.85 -49.79 12.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.497 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 30.1 tt0 -53.98 -59.69 4.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.0 109.504 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.787 ' CG ' HD21 ' B' ' 35' ' ' LEU . 45.5 m-85 -60.43 -47.57 85.55 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.233 -0.917 . . . . 0.0 109.62 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.602 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 97.6 p -61.77 -14.98 37.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.193 -0.942 . . . . 0.0 109.589 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.26 -31.27 66.32 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' B' ' 17' ' ' TYR . 1.4 mtt-85 -77.33 -10.9 59.72 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -1.128 . . . . 0.0 109.404 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -79.66 170.02 17.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.67 -35.51 35.95 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.498 ' CB ' ' HD2' ' B' ' 26' ' ' LYS . 2.5 t0 -75.38 -24.05 57.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -1.119 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 23' ' ' ASP . 6.7 mttp 66.4 25.98 10.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.59 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' HIS . . . . . 0.533 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -160.69 22.93 0.14 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.558 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.533 ' CE ' ' HB3' ' B' ' 25' ' ' HIS . 0.1 OUTLIER -168.67 169.03 10.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.24 -0.913 . . . . 0.0 109.513 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.803 HD13 ' SG ' ' B' ' 68' ' ' CYS . 7.7 mp -122.36 138.73 54.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.883 . . . . 0.0 109.786 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.537 ' CD ' ' OE2' ' B' ' 31' ' ' GLU . 0.2 OUTLIER -89.77 169.02 11.63 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.028 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.6 mtmt -42.14 -26.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.037 -1.04 . . . . 0.0 109.854 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.451 ' N ' ' O ' ' B' ' 28' ' ' LYS . 36.3 t -77.88 -51.92 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 110.97 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.609 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -58.16 -38.58 76.88 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.76 -1.212 . . . . 0.0 109.026 -179.377 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.957 HD22 ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -58.8 -67.28 0.38 Allowed 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.469 -0.769 . . . . 0.0 108.94 179.17 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HD3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.08 -30.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.3 OUTLIER -63.75 -64.29 0.93 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.303 179.843 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.787 HD21 ' CG ' ' B' ' 17' ' ' TYR . 4.2 mm? -46.01 -40.32 10.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.33 -0.856 . . . . 0.0 109.65 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.878 HG21 ' CG2' ' B' ' 53' ' ' VAL . 1.7 mp -62.18 -41.82 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.068 -1.02 . . . . 0.0 109.945 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.14 -73.81 0.37 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.033 -1.042 . . . . 0.0 111.394 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' ASN . . . . . 0.426 ' C ' ' ND2' ' B' ' 38' ' ' ASN . 0.1 OUTLIER -68.18 -1.15 5.52 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.032 -1.043 . . . . 0.0 111.465 -178.071 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.562 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -131.03 -9.68 3.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.7 -1.25 . . . . 0.0 110.313 -179.92 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.768 HD11 ' HE3' ' A' ' 7' ' ' MET . 1.6 tp -141.48 78.3 1.63 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.705 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.151 -0.968 . . . . 0.0 109.739 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.702 ' CD1' HG21 ' B' ' 53' ' ' VAL . 2.0 mt . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.472 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER -42.47 -31.85 0.48 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.753 -179.747 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.472 ' CG ' ' O ' ' B' ' 48' ' ' LYS . 0.9 OUTLIER 171.39 65.27 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.216 -0.928 . . . . 0.0 109.405 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 47.97 48.35 18.07 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.931 . . . . 0.0 109.193 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.449 ' OE1' ' HG3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.05 -64.1 1.19 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.795 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 1.022 ' CG1' HG13 ' B' ' 80' ' ' VAL . 1.3 t -90.83 -20.9 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.19 -0.944 . . . . 0.0 109.692 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HD3' ' B' ' 33' ' ' LYS . 37.6 t -82.92 -31.35 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 120.803 -1.185 . . . . 0.0 108.993 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.54 -27.67 19.01 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.287 -0.883 . . . . 0.0 109.15 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -86.51 -46.09 10.49 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.333 -0.855 . . . . 0.0 109.447 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 1.134 HG22 HD21 ' B' ' 60' ' ' LEU . 1.2 p -63.52 -41.41 92.56 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.037 -1.04 . . . . 0.0 108.904 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.552 ' CE ' HD13 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.49 -49.25 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.852 -0.53 . . . . 0.0 109.658 179.784 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -61.7 -44.85 96.14 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.453 ' C ' HD23 ' B' ' 60' ' ' LEU . 34.2 m -65.74 -13.74 59.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.436 -0.79 . . . . 0.0 109.793 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 1.134 HD21 HG22 ' B' ' 56' ' ' VAL . 2.4 mt -87.17 -44.94 11.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.037 -1.039 . . . . 0.0 109.169 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' B' ' 57' ' ' MET . 8.3 m-20 -42.75 112.35 0.35 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.605 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -44.44 -45.58 9.16 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.31 -0.869 . . . . 0.0 109.611 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -155.18 19.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.169 -0.957 . . . . 0.0 109.762 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.13 95.5 2.28 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 t0 179.8 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.275 -1.132 . . . . 0.0 108.442 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 -21.21 28.94 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' B' ' 26' ' ' LYS . 5.3 mm-40 -69.88 108.1 3.84 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.233 -1.157 . . . . 0.0 109.29 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.803 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.4 OUTLIER -69.69 128.1 35.26 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.215 -0.928 . . . . 0.0 109.727 -179.548 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.512 ' N ' ' OE1' ' B' ' 72' ' ' GLU . 9.1 m-20 -100.55 170.3 8.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.27 -0.894 . . . . 0.0 108.649 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.41 ' CD1' HG21 ' A' ' 82' ' ' THR . 0.8 OUTLIER -60.29 -59.37 5.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.757 -1.214 . . . . 0.0 110.148 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.523 ' HA ' ' HG2' ' B' ' 74' ' ' MET . 2.4 mt-30 -52.44 -24.69 8.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.046 -1.034 . . . . 0.0 109.084 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' B' ' 60' ' ' LEU . 0.1 OUTLIER -76.95 -38.15 53.85 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.349 -0.845 . . . . 0.0 109.389 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.549 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 24.7 t80 -68.46 -48.79 63.6 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.197 -0.939 . . . . 0.0 109.092 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.7 ' HB3' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -54.24 -46.48 72.58 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.307 -0.87 . . . . 0.0 109.337 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.505 ' N ' ' SD ' ' B' ' 74' ' ' MET . . . -74.73 -20.1 59.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.165 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.774 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.4 OUTLIER -72.73 -71.11 0.31 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 109.233 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.642 HG21 ' CD2' ' A' ' 3' ' ' LEU . 53.1 t -57.54 -31.29 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.111 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.539 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -59.76 -42.06 92.41 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.338 -0.851 . . . . 0.0 109.227 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.9 mmm -73.63 -70.06 0.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 0.0 109.618 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 1.022 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.32 -25.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 120.891 -1.13 . . . . 0.0 109.591 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.42 ' N ' ' O ' ' B' ' 79' ' ' MET . 11.8 m -70.96 -67.74 0.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.973 -1.079 . . . . 0.0 108.885 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.585 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 0.9 OUTLIER -82.98 -52.95 6.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.057 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.09 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.261 0.553 . . . . 0.0 109.881 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' B' ' 82' ' ' THR . 41.4 t -72.78 -52.69 13.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.565 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -9.91 50.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.266 -0.896 . . . . 0.0 109.583 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -81.85 -20.15 39.55 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.24 -0.912 . . . . 0.0 109.48 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.489 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.508 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 1.013 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 3.0 tt0 -64.32 -50.41 67.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.896 . . . . 0.0 109.468 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.678 HD21 HG11 ' B' ' 13' ' ' VAL . 1.2 mp -79.94 -27.5 39.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.57 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' B' ' 39' ' ' GLU . 37.7 tt0 -60.99 -50.54 72.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 109.525 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -52.88 15.62 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.297 -0.877 . . . . 0.0 109.251 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.747 ' HB1' HD23 ' B' ' 10' ' ' LEU . . . -61.9 -13.26 23.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.926 . . . . 0.0 109.504 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' MET . . . . . 0.524 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 42.3 ttp -80.09 -59.08 2.85 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.219 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 75.9 t -57.09 -24.51 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.224 -0.923 . . . . 0.0 109.266 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.11 -51.82 9.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.61 HD23 HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -57.53 -60.66 3.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 109.426 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.669 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 6.9 mt -53.06 -43.97 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.274 -0.891 . . . . 0.0 109.227 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 9.3 m-20 -54.16 -37.18 64.16 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.375 -0.828 . . . . 0.0 109.247 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.821 HG22 ' CE1' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -66.29 -39.77 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.18 -0.95 . . . . 0.0 109.188 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -53.74 -62.85 1.38 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.985 -1.072 . . . . 0.0 108.286 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -66.19 -10.04 37.61 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.291 -0.881 . . . . 0.0 109.13 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 13' ' ' VAL . 1.7 tp60 -67.26 -66.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 109.91 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 1.006 ' CE2' HD22 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -125.05 35.35 4.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.697 -1.252 . . . . 0.0 110.708 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.781 ' OG ' HD21 ' A' ' 27' ' ' LEU . 37.6 m -91.4 -22.36 20.51 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.922 -1.111 . . . . 0.0 109.201 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.507 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -103.36 20.72 41.6 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -60.42 -61.91 2.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -1.132 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -122.87 164.83 17.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.431 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.39 -128.62 11.63 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.565 ' HB2' ' CE1' ' A' ' 25' ' ' HIS . 3.9 m-20 -88.99 -148.81 0.18 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -1.144 . . . . 0.0 109.46 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 14.9 ttpt -145.04 65.81 1.26 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 109.476 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CE1' ' HB2' ' A' ' 23' ' ' ASP . 2.8 p80 -170.33 -34.22 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.227 -0.921 . . . . 0.0 109.969 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.538 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -125.46 170.4 11.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.135 -0.978 . . . . 0.0 110.006 -179.524 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 ' OG ' ' A' ' 18' ' ' SER . 8.1 mt -104.19 170.52 7.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.425 -0.797 . . . . 0.0 109.929 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -133.54 69.89 1.47 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.317 -0.864 . . . . 0.0 109.667 179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 65.21 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.59 -0.694 . . . . 0.0 111.064 179.121 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 m -46.14 -42.32 13.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 110.594 -178.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.832 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.8 mm-40 -59.86 -40.31 88.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.932 -1.105 . . . . 0.0 108.919 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.747 ' CD2' HD13 ' A' ' 60' ' ' LEU . 1.5 mp -55.76 -60.18 3.81 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.637 ' CG ' HG11 ' A' ' 53' ' ' VAL . 9.1 mttt -41.56 -50.97 4.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.237 -0.914 . . . . 0.0 109.93 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 38' ' ' ASN . 0.2 OUTLIER -60.23 -39.42 86.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.998 -1.064 . . . . 0.0 110.126 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.006 HD22 ' CE2' ' A' ' 17' ' ' TYR . 3.8 mm? -52.71 -56.58 14.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.463 -0.773 . . . . 0.0 110.263 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 1.056 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mp -94.29 -57.02 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 120.93 -1.106 . . . . 0.0 109.788 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.95 ' ND2' HD11 ' A' ' 47' ' ' ILE . 1.6 m120 -43.96 -26.19 0.26 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.162 -0.961 . . . . 0.0 109.565 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 34' ' ' GLU . 5.4 t30 -99.82 -41.91 7.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.151 -0.968 . . . . 0.0 109.627 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 58.0 mm-40 -72.05 -62.78 1.31 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.056 HD13 HG23 ' A' ' 36' ' ' ILE . 5.9 mp -41.71 -65.74 0.42 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.394 -0.817 . . . . 0.0 109.57 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.447 179.888 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 1.0 HG13 HG21 ' A' ' 53' ' ' VAL . 45.0 mm . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -42.8 -44.09 4.28 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.417 -0.802 . . . . 0.0 109.342 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.66 ' O ' HG22 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -127.47 153.13 46.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.379 -0.826 . . . . 0.0 109.126 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 1.6 pt20 -85.76 55.55 3.57 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.28 -0.888 . . . . 0.0 109.413 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.52 -45.6 8.84 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 109.954 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.859 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -98.66 -25.78 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.035 . . . . 0.0 110.076 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.0 HG21 HG13 ' A' ' 47' ' ' ILE . 52.0 t -81.92 -24.73 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.812 -1.18 . . . . 0.0 109.354 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -90.23 -37.06 14.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.167 -0.958 . . . . 0.0 108.916 179.247 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -78.26 -47.39 18.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.426 -0.796 . . . . 0.0 109.268 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.687 HG13 HD12 ' A' ' 60' ' ' LEU . 2.9 p -59.12 -44.33 91.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.519 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 10.7 tpt -41.8 -48.76 4.36 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.603 -0.686 . . . . 0.0 109.949 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -57.16 -56.35 22.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.183 -0.948 . . . . 0.0 109.422 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 59' ' ' THR . 7.8 m -66.54 -8.67 28.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.306 -0.871 . . . . 0.0 109.574 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.813 HD22 ' OE1' ' A' ' 72' ' ' GLU . 63.7 mt -96.15 -17.29 20.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 -179.553 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 62' ' ' ASN . 8.9 m-20 -59.1 113.37 2.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.167 -0.958 . . . . 0.0 109.393 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.424 ' OD1' ' OD2' ' A' ' 69' ' ' ASP . 14.5 t30 -43.5 -47.75 7.25 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 109.535 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -165.84 40.86 0.06 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.41 87.8 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.7 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.311 -1.111 . . . . 0.0 108.632 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 -19.22 27.56 Favored Glycine 0 N--CA 1.485 1.94 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 1.3 mt-10 -71.79 103.2 3.04 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -1.149 . . . . 0.0 109.41 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' CYS . . . . . 0.541 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -70.05 137.02 50.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.303 -0.873 . . . . 0.0 109.258 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 6.5 m-20 -116.85 170.56 8.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.416 -0.803 . . . . 0.0 109.163 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.669 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -52.08 -50.42 61.59 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.056 -1.028 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.562 ' O ' ' HE3' ' A' ' 74' ' ' MET . 0.0 OUTLIER -48.49 -35.73 13.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 109.155 -179.716 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.813 ' OE1' HD22 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.53 -31.84 47.72 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.969 -1.082 . . . . 0.0 109.369 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -53.55 -51.48 62.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.977 -1.077 . . . . 0.0 108.966 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.807 ' HE3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -67.13 -38.36 85.42 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.401 -0.812 . . . . 0.0 109.353 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.807 ' HB2' ' HE3' ' A' ' 74' ' ' MET . . . -68.47 -15.76 63.66 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.081 -1.012 . . . . 0.0 108.866 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.63 ' O ' HG23 ' A' ' 80' ' ' VAL . 1.0 OUTLIER -82.7 -72.29 0.45 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.388 -0.82 . . . . 0.0 109.216 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.567 ' CG2' HD23 ' B' ' 3' ' ' LEU . 54.1 t -54.28 -32.92 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 O-C-N 121.226 -0.921 . . . . 0.0 108.921 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -65.38 -42.02 93.14 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.508 -0.745 . . . . 0.0 109.849 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.721 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 41.6 mmm -77.53 -71.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.914 -1.116 . . . . 0.0 110.089 -179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.859 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -45.07 -23.14 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 O-C-N 120.436 -1.415 . . . . 0.0 109.83 -178.682 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.612 HG21 HD11 ' B' ' 11' ' ' ILE . 18.5 m -80.77 -66.28 0.9 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.816 -1.178 . . . . 0.0 108.643 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.75 -50.2 10.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 108.596 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.38 -41.51 0.64 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.758 -0.589 . . . . 0.0 109.739 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 16.4 t -63.78 -49.51 72.66 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.262 -0.899 . . . . 0.0 109.598 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.51 -21.67 64.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.522 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -90.04 -21.98 22.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 1' ' ' SER . . . . . 0.409 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -76.34 0.09 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 0.0 109.49 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.61 HD11 HD23 ' A' ' 10' ' ' LEU . 2.8 mp -62.48 -15.75 51.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.918 . . . . 0.0 109.431 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 4' ' ' GLU . . . . . 0.438 ' O ' HG23 ' B' ' 8' ' ' VAL . 1.6 tp10 -73.01 -69.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -58.97 -49.57 77.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 109.322 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' B' ' 7' ' ' MET . . . -54.89 -56.42 19.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.325 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' MET . . . . . 0.523 ' CB ' ' O ' ' B' ' 3' ' ' LEU . 15.5 ttp -43.83 -39.0 3.59 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.385 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 4' ' ' GLU . 87.0 t -61.28 -48.86 87.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.425 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ALA . . . . . 1.013 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -62.02 -61.48 2.45 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.565 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' LEU . . . . . 1.006 HD12 ' CZ ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -43.43 -39.12 3.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.312 -0.867 . . . . 0.0 109.489 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.801 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 13.5 mm -61.66 -51.51 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.128 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 6.9 t0 -58.95 -17.06 21.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.321 -0.862 . . . . 0.0 109.229 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.759 HG13 ' CD2' ' B' ' 35' ' ' LEU . 1.3 t -76.5 -53.18 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.286 -0.884 . . . . 0.0 109.166 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.8 t80 -55.1 -50.98 67.84 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.812 -1.18 . . . . 0.0 109.384 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -63.84 1.0 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.166 -0.959 . . . . 0.0 109.93 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.447 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 0.9 OUTLIER -45.31 -68.73 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.806 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.637 ' HE2' HG22 ' B' ' 13' ' ' VAL . 23.4 m-85 -42.73 -34.12 0.86 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.384 -0.822 . . . . 0.0 109.722 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' SER . . . . . 0.536 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -85.69 50.0 1.88 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.19 -0.944 . . . . 0.0 109.294 179.762 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.61 -44.3 1.7 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -23.06 21.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.326 -1.103 . . . . 0.0 109.456 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER -69.84 102.47 1.95 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.213 -0.929 . . . . 0.0 109.504 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . 44.1 -95.84 0.01 OUTLIER Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' B' ' 21' ' ' GLU . 0.4 OUTLIER -112.49 -81.23 0.59 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -1.157 . . . . 0.0 109.411 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 24' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' B' ' 18' ' ' SER . 0.1 OUTLIER 175.77 56.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.261 -0.899 . . . . 0.0 109.378 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -136.88 6.63 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.189 -0.944 . . . . 0.0 109.7 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.554 ' O ' HD23 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -170.1 170.53 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.126 -0.984 . . . . 0.0 109.689 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.873 HD13 HD11 ' B' ' 35' ' ' LEU . 26.1 mt -126.54 130.74 51.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.235 -0.915 . . . . 0.0 110.122 -179.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' C ' ' B' ' 29' ' ' LYS . 3.2 ttmt -69.67 154.03 42.57 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.809 ' HA ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.45 -32.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.314 -0.866 . . . . 0.0 109.718 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.8 OUTLIER -76.31 -46.58 27.09 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.322 -0.861 . . . . 0.0 109.481 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.732 ' O ' HD12 ' B' ' 35' ' ' LEU . 0.4 OUTLIER -52.67 -42.96 65.21 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.179 -0.951 . . . . 0.0 108.988 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.825 HD21 ' CB ' ' B' ' 68' ' ' CYS . 5.6 mt -60.3 -66.32 0.54 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.648 -0.657 . . . . 0.0 109.306 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.629 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.6 OUTLIER -42.88 -27.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 109.364 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -66.53 -51.59 54.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -0.873 . . . . 0.0 109.329 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.873 HD11 HD13 ' B' ' 27' ' ' LEU . 2.3 mp -56.77 -42.12 78.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.263 -0.898 . . . . 0.0 109.475 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.546 HG23 ' HB2' ' B' ' 40' ' ' LEU . 3.4 mt -79.91 -14.13 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.268 -0.895 . . . . 0.0 109.563 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -89.38 -14.73 34.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 109.533 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -99.69 -35.43 9.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 0.0 109.507 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.555 ' OE1' HD12 ' B' ' 40' ' ' LEU . 3.2 tm-20 -110.31 -10.01 14.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.505 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' B' ' 81' ' ' THR . 0.3 OUTLIER -131.6 68.08 1.5 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.233 -0.917 . . . . 0.0 109.58 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' ILE . . . . . 0.657 HG21 ' CG2' ' B' ' 53' ' ' VAL . 9.0 mm . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.4 mttt 43.81 32.68 0.62 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.124 -0.985 . . . . 0.0 109.382 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 50.8 tt0 83.14 -43.1 0.11 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.63 -0.668 . . . . 0.0 109.878 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.506 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.2 OUTLIER 176.22 56.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.0 109.645 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -90.55 -69.7 0.71 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -0.932 . . . . 0.0 109.529 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.952 ' CG1' HG13 ' B' ' 80' ' ' VAL . 17.0 t -85.56 -22.22 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.196 -0.94 . . . . 0.0 109.688 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' VAL . . . . . 0.657 ' CG2' HG21 ' B' ' 47' ' ' ILE . 47.8 t -78.86 -36.02 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.147 -0.97 . . . . 0.0 109.366 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.506 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 23.7 t70 -76.58 -35.66 58.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.252 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -73.53 -45.68 52.22 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.879 . . . . 0.0 109.385 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' VAL . . . . . 1.059 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 25.9 m -59.77 -43.36 91.5 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.147 -0.97 . . . . 0.0 109.69 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 57' ' ' MET . . . . . 0.496 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -41.62 -28.11 0.12 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.972 -1.08 . . . . 0.0 109.419 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.6 tm-20 -83.63 -46.25 12.55 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' THR . . . . . 0.477 ' O ' ' C ' ' B' ' 60' ' ' LEU . 7.5 m -68.76 -65.12 0.74 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 109.054 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 60' ' ' LEU . . . . . 0.644 HD13 ' CD2' ' B' ' 76' ' ' PHE . 21.0 mt -36.44 -62.58 0.45 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.81 -0.556 . . . . 0.0 109.693 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' HA2' ' B' ' 64' ' ' GLY . 5.1 t70 -56.62 98.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.402 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 62' ' ' ASN . . . . . 0.456 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 4.6 m-80 -96.33 -11.17 26.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -105.45 -40.67 5.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -0.922 . . . . 0.0 109.479 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' GLY . . . . . 0.46 ' HA2' ' OD1' ' B' ' 61' ' ' ASP . . . 101.82 95.39 2.26 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 176.71 -32.48 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.211 -1.17 . . . . 0.0 108.61 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 12.82 16.85 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 67' ' ' GLU . . . . . 0.523 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 20.0 pt-20 -110.39 116.51 31.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.24 -1.153 . . . . 0.0 109.337 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 68' ' ' CYS . . . . . 0.825 ' CB ' HD21 ' B' ' 32' ' ' LEU . 9.0 t -73.04 152.77 41.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.2 -0.937 . . . . 0.0 109.765 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.463 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -115.38 171.8 7.48 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.801 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 1.0 OUTLIER -55.34 -51.46 66.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.123 -0.986 . . . . 0.0 110.305 -179.669 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 71' ' ' GLN . . . . . 0.476 ' OE1' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -59.98 -36.33 76.93 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.314 -0.867 . . . . 0.0 108.975 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.476 ' HG2' ' OE1' ' B' ' 71' ' ' GLN . 3.4 mt-10 -79.82 -13.12 59.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.091 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 1.006 ' CZ ' HD12 ' B' ' 10' ' ' LEU . 0.0 OUTLIER -73.88 -60.35 2.3 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.654 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 74' ' ' MET . . . . . 0.567 ' SD ' ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -67.78 -24.43 65.32 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.524 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -70.14 -30.54 67.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.301 -0.874 . . . . 0.0 108.731 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 1.059 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.8 OUTLIER -75.71 -69.02 0.51 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.226 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD22 ' A' ' 3' ' ' LEU . 42.9 t -49.22 -36.12 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.321 -0.862 . . . . 0.0 109.408 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.54 ' CB ' ' HG2' ' A' ' 74' ' ' MET . . . -66.17 -38.39 87.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.873 . . . . 0.0 110.438 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.73 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 58.5 mtm -78.2 -71.35 0.43 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.888 -1.133 . . . . 0.0 109.795 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 80' ' ' VAL . . . . . 0.952 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -45.41 -23.49 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 O-C-N 120.452 -1.405 . . . . 0.0 109.585 -179.13 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 81' ' ' THR . . . . . 0.952 ' HA ' HD21 ' B' ' 40' ' ' LEU . 11.8 m -79.09 -67.27 0.77 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.926 -1.109 . . . . 0.0 108.678 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 82' ' ' THR . . . . . 0.58 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.2 t -80.71 -50.74 9.5 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.206 -0.934 . . . . 0.0 108.615 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.73 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.01 -31.21 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.331 0.586 . . . . 0.0 109.657 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 84' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' B' ' 82' ' ' THR . 48.2 t -85.25 -43.59 13.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 0.0 109.516 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' B' ' 82' ' ' THR . 54.4 t-80 -48.07 -33.51 8.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.523 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' B' ' 87' ' ' PHE . 2.0 tt0 -87.97 -28.36 21.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.525 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 87' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' B' ' 84' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' B' ' 39' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.685 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -71.88 -59.92 2.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.446 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -72.31 -23.96 61.25 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.455 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.44 ' HB3' ' N ' ' A' ' 1' ' ' SER . 10.6 tm-20 -62.77 -61.25 2.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -41.9 94.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.226 -0.921 . . . . 0.0 109.326 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.89 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -66.91 -19.07 65.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.264 -0.898 . . . . 0.0 109.42 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.66 ' O ' HD12 ' A' ' 11' ' ' ILE . 2.2 mtp -76.32 -44.13 38.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.401 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 8' ' ' VAL . 3.5 t -65.94 -38.18 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.501 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -75.04 -65.67 0.85 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.481 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.983 HD11 ' HB1' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -43.76 -41.24 4.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.448 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.66 HD12 ' O ' ' A' ' 7' ' ' MET . 61.9 mt -62.19 -45.23 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -56.99 -27.37 61.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.227 -0.921 . . . . 0.0 109.357 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.037 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -80.01 -28.7 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.266 -0.897 . . . . 0.0 109.068 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 34.4 t80 -66.33 -45.69 79.4 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.055 -1.028 . . . . 0.0 109.45 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 8.1 m-70 -80.32 -34.55 36.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.597 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.14 -63.38 1.26 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.494 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.501 ' HE1' HG22 ' A' ' 13' ' ' VAL . 43.8 m-85 -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.543 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 82.9 p -61.18 -21.09 63.48 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.288 -0.883 . . . . 0.0 109.486 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.482 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -66.73 -31.99 80.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.3 mmt180 -52.51 -41.56 63.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -1.132 . . . . 0.0 109.477 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 23' ' ' ASP . 43.6 tt0 -76.6 81.89 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.451 ' O ' ' O ' ' A' ' 23' ' ' ASP . . . 43.63 -95.23 0.01 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -57.91 -158.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -1.133 . . . . 0.0 109.448 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.8 pttp -153.93 89.79 1.33 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 109.412 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.564 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -169.05 -36.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.543 ' N ' ' HB2' ' A' ' 18' ' ' SER . 0.0 OUTLIER -122.74 170.11 10.39 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 109.557 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.872 HD23 ' C ' ' A' ' 31' ' ' GLU . 2.9 mp -110.4 143.65 40.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.274 -0.891 . . . . 0.0 109.503 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 30' ' ' SER . 1.5 tttp -98.56 84.64 3.2 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.301 -0.875 . . . . 0.0 109.282 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' A' ' 30' ' ' SER . 29.1 ttmt 43.17 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.425 -0.797 . . . . 0.0 110.847 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' A' ' 28' ' ' LYS . 2.0 t -47.61 -31.89 4.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.156 -0.965 . . . . 0.0 110.06 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.872 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -58.85 -45.62 89.63 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.832 -1.168 . . . . 0.0 108.64 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.933 HD11 ' SG ' ' A' ' 68' ' ' CYS . 27.1 mt -58.65 -54.95 41.25 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' HG21 ' A' ' 53' ' ' VAL . 1.2 tttt -46.31 -42.46 14.69 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.386 -0.821 . . . . 0.0 109.391 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -58.47 7.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.037 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.23 -40.25 58.4 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.335 -0.853 . . . . 0.0 109.663 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.628 HD13 HG22 ' A' ' 53' ' ' VAL . 48.0 mt -61.75 -36.33 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.203 -0.936 . . . . 0.0 109.951 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLU . 6.8 m120 -94.92 -71.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.085 -1.01 . . . . 0.0 109.779 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 37' ' ' ASN . 2.6 t-20 -41.53 -27.08 0.08 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.421 -0.799 . . . . 0.0 110.111 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.978 ' HG3' HD23 ' A' ' 35' ' ' LEU . 1.6 mm-40 -112.03 -46.14 3.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.09 -1.006 . . . . 0.0 109.726 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.812 ' CG ' HD21 ' A' ' 44' ' ' LEU . 9.3 mp -106.9 61.97 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.103 -0.998 . . . . 0.0 109.582 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.3 p -112.06 13.96 20.72 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.218 -0.926 . . . . 0.0 109.409 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.24 -56.15 1.64 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.44 -43.59 93.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.898 . . . . 0.0 109.481 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.812 HD21 ' CG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -116.84 90.89 3.43 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.236 -0.915 . . . . 0.0 109.557 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -85.6 9.66 15.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.249 -0.907 . . . . 0.0 109.453 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.473 ' CD ' ' HG ' ' A' ' 84' ' ' CYS . 4.5 pm0 -67.83 -136.31 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.282 -0.886 . . . . 0.0 109.407 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.578 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 1.1 mt 64.75 -146.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.968 -1.082 . . . . 0.0 109.213 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.568 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 12.5 mttt 83.59 -44.58 0.11 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.553 -0.717 . . . . 0.0 109.367 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 60.9 mm-40 -110.32 14.69 22.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.238 -0.914 . . . . 0.0 109.03 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.536 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.4 mt-30 78.34 59.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.711 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 3.7 mp0 -90.08 -70.6 0.66 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.215 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.837 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t -91.44 -21.18 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.126 -0.984 . . . . 0.0 108.629 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.628 HG22 HD13 ' A' ' 36' ' ' ILE . 55.2 t -73.22 -30.73 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.368 -0.832 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -90.09 -40.42 12.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.405 -0.809 . . . . 0.0 109.113 179.624 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -64.41 -35.5 81.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.326 -0.859 . . . . 0.0 109.272 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.837 HG13 ' O ' ' A' ' 52' ' ' VAL . 4.4 m -55.38 -56.54 11.17 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.263 -0.898 . . . . 0.0 109.716 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.645 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -41.49 -28.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.001 -1.062 . . . . 0.0 109.626 -179.768 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.1 tp10 -69.59 -55.99 8.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.285 -0.884 . . . . 0.0 108.788 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.468 ' O ' ' C ' ' A' ' 60' ' ' LEU . 9.6 m -81.28 -61.68 1.88 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 108.877 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.721 HD13 ' HB ' ' A' ' 56' ' ' VAL . 6.5 mp -37.82 -36.43 0.19 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.695 -0.628 . . . . 0.0 109.79 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 57' ' ' MET . 28.0 t0 -89.98 95.73 10.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.213 -0.93 . . . . 0.0 109.433 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -109.69 11.23 24.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.248 -0.908 . . . . 0.0 109.498 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -120.97 -30.21 4.44 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.518 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.33 90.77 0.56 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.87 -32.47 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.271 -1.135 . . . . 0.0 108.618 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.2 31.15 Favored Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.471 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 21.9 mt-10 -88.25 107.12 18.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -1.166 . . . . 0.0 109.402 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.933 ' SG ' HD11 ' A' ' 32' ' ' LEU . 4.3 m -69.82 143.58 52.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.256 -0.902 . . . . 0.0 109.797 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.0 m-20 -116.62 169.5 9.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.492 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -51.0 -47.48 61.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.233 -0.917 . . . . 0.0 110.072 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.577 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 16.6 mt-30 -47.92 -42.09 26.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.44 -0.787 . . . . 0.0 109.582 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.57 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.03 -25.02 43.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.163 -0.961 . . . . 0.0 109.979 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.457 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 10.4 t80 -59.3 -58.32 9.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.069 -1.019 . . . . 0.0 109.407 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.921 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -68.36 -49.73 58.15 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.233 -0.917 . . . . 0.0 109.46 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB3' ' A' ' 78' ' ' ALA . . . -54.96 -23.47 19.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.117 -0.99 . . . . 0.0 108.973 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.815 ' CE1' HG21 ' A' ' 80' ' ' VAL . 2.2 t80 -70.3 -63.67 1.04 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HG23 ' A' ' 80' ' ' VAL . 3.3 t -52.91 -23.57 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' B' ' 74' ' ' MET . . . -62.33 -54.23 43.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.421 -0.799 . . . . 0.0 108.865 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 1.4 mmm -70.52 -69.44 0.36 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.379 -0.825 . . . . 0.0 109.479 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.815 HG21 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.03 -25.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 120.567 -1.333 . . . . 0.0 110.129 -179.416 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.2 m -76.36 -69.98 0.47 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.919 -1.113 . . . . 0.0 108.512 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.572 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.6 t -78.04 -49.91 13.09 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.95 -47.75 1.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 44' ' ' LEU . 9.2 t -61.27 -47.12 87.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.471 -0.768 . . . . 0.0 109.286 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -9.93 51.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.25 -0.906 . . . . 0.0 109.488 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 87' ' ' PHE . 0.8 OUTLIER -82.68 -21.06 35.05 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.313 -0.867 . . . . 0.0 109.498 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -44.08 -26.53 0.3 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.25 -0.906 . . . . 0.0 109.486 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.403 ' N ' ' O ' ' A' ' 86' ' ' GLU . 18.6 m-85 -74.37 -54.11 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.459 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -93.65 131.36 39.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.5 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -138.7 112.55 8.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 109.437 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.478 -179.967 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.532 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 3' ' ' LEU . 1.3 tp10 -70.38 -55.35 9.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.719 HD21 HG11 ' A' ' 13' ' ' VAL . 3.1 mm? -75.44 -27.64 59.02 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 0.0 109.39 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.532 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 2.8 tm-20 -67.15 -61.55 1.87 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.82 -49.3 71.37 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.92 . . . . 0.0 109.41 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.983 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -65.02 -22.59 67.02 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.289 -0.882 . . . . 0.0 109.453 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.48 ' HG2' HD12 ' B' ' 11' ' ' ILE . 5.3 ttt -68.95 -42.61 76.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.427 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.8 t -70.34 -34.16 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.217 -0.927 . . . . 0.0 109.433 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.685 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -65.73 -64.46 0.86 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.243 -0.911 . . . . 0.0 109.472 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.804 HD22 ' SD ' ' B' ' 74' ' ' MET . 0.4 OUTLIER -50.74 -47.94 59.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.473 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 88.7 mt -56.42 -36.0 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.179 -0.951 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.7 OUTLIER -67.6 -29.85 69.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.244 -0.91 . . . . 0.0 109.439 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 1.072 HG13 HD11 ' B' ' 35' ' ' LEU . 10.8 t -75.72 -25.02 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.4 t80 -74.69 -50.95 15.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.996 -1.065 . . . . 0.0 109.478 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.446 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 15.6 m80 -78.28 -20.82 50.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.25 -0.906 . . . . 0.0 109.832 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 53.3 tt0 -83.13 -60.29 2.2 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.139 -0.976 . . . . 0.0 109.565 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.648 ' CD2' HD13 ' B' ' 35' ' ' LEU . 28.0 m-85 -63.32 -28.18 69.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.889 . . . . 0.0 109.541 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' B' ' 25' ' ' HIS . 84.6 p -71.09 -20.48 62.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.189 -0.945 . . . . 0.0 109.69 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.96 30.28 10.71 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.14 -59.49 2.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -1.144 . . . . 0.0 109.529 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 22' ' ' GLY . 0.2 OUTLIER -114.74 97.54 6.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.9 . . . . 0.0 109.513 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 49.78 -179.85 0.02 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' B' ' 22' ' ' GLY . 81.0 m-20 52.06 174.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -1.162 . . . . 0.0 109.452 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -172.44 59.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.24 -0.912 . . . . 0.0 109.511 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.523 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -169.2 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.275 -0.891 . . . . 0.0 109.542 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.488 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 1.4 mptt -122.97 160.75 25.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 109.54 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.763 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.8 mp -109.27 132.29 54.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.928 . . . . 0.0 109.584 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -79.73 170.12 16.98 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -45.82 -25.01 0.45 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.879 -1.138 . . . . 0.0 109.324 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.509 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 0.2 OUTLIER -82.28 -50.54 8.84 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.646 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.763 ' C ' HD23 ' B' ' 27' ' ' LEU . 43.0 mt-10 -56.68 -38.65 72.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.13 . . . . 0.0 109.402 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.873 HD22 HD23 ' B' ' 60' ' ' LEU . 16.0 mt -65.02 -57.44 8.68 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.594 -0.691 . . . . 0.0 109.293 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 1.13 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -42.27 -50.29 4.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.339 -0.851 . . . . 0.0 109.497 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -51.58 -61.62 2.13 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.188 -0.945 . . . . 0.0 109.151 179.736 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 1.072 HD11 HG13 ' B' ' 13' ' ' VAL . 1.1 tp -43.47 -38.1 2.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.311 -0.868 . . . . 0.0 109.43 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 1.045 HG13 HG22 ' B' ' 53' ' ' VAL . 3.0 mm -57.18 -49.93 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.229 -0.919 . . . . 0.0 109.586 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' B' ' 39' ' ' GLU . 51.1 m-80 -93.01 -65.35 1.0 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 109.807 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' B' ' 37' ' ' ASN . 0.6 OUTLIER -41.14 -26.92 0.06 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.412 -0.805 . . . . 0.0 110.265 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 3.9 mm-40 -118.73 -40.54 2.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.987 -1.071 . . . . 0.0 109.986 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.97 ' HB3' HD13 ' B' ' 44' ' ' LEU . 5.3 mp -108.14 67.11 0.66 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.094 -1.004 . . . . 0.0 109.596 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 28.1 t -107.84 26.56 10.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 109.417 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.81 -77.28 0.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.917 . . . . 0.0 109.502 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -85.52 -8.44 58.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.897 . . . . 0.0 109.554 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.97 HD13 ' HB3' ' B' ' 40' ' ' LEU . 3.1 mp -105.9 -12.36 15.87 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.198 -0.938 . . . . 0.0 109.473 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 48.75 -150.97 0.15 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.443 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' B' ' 47' ' ' ILE . 55.0 mm-40 -86.32 58.68 5.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 109.397 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.72 HD12 ' CG2' ' B' ' 53' ' ' VAL . 10.5 mm 57.26 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.31 -0.869 . . . . 0.0 109.437 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.1 mmtp -111.28 55.33 0.66 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.501 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 3.0 tp10 74.31 41.79 0.36 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.261 -0.9 . . . . 0.0 109.353 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.455 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 72.51 51.48 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.304 -0.872 . . . . 0.0 109.447 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 24.7 tt0 -88.65 -70.16 0.66 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.492 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 1.4 t -87.47 -21.21 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.349 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.13 HG11 ' CD ' ' B' ' 33' ' ' LYS . 77.0 t -73.54 -26.06 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.207 -0.933 . . . . 0.0 109.27 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -85.16 -47.95 9.62 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 109.438 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 14.0 mttt -62.58 -41.9 99.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.213 -0.929 . . . . 0.0 109.395 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.917 ' HB ' HD13 ' B' ' 60' ' ' LEU . 31.1 m -59.28 -49.34 83.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 O-C-N 121.196 -0.94 . . . . 0.0 109.474 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -44.5 -26.38 0.35 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.977 -1.077 . . . . 0.0 109.453 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 55' ' ' LYS . 0.8 OUTLIER -77.08 -45.79 25.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.224 -0.922 . . . . 0.0 108.994 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.443 ' O ' ' C ' ' B' ' 60' ' ' LEU . 66.5 m -84.31 -63.81 1.27 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.312 -0.867 . . . . 0.0 109.371 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.917 HD13 ' HB ' ' B' ' 56' ' ' VAL . 9.1 mp -41.73 -27.86 0.12 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.585 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' B' ' 57' ' ' MET . 3.6 m-20 -63.55 114.68 4.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.256 -0.903 . . . . 0.0 109.333 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' B' ' 67' ' ' GLU . 16.5 t30 -42.77 -44.31 4.34 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.386 -0.821 . . . . 0.0 109.623 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.73 28.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.245 -0.909 . . . . 0.0 109.566 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.3 90.87 1.18 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' B' ' 65' ' ' ASP . 43.5 t0 -179.34 -34.44 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.11 . . . . 0.0 108.581 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.479 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.12 38.65 1.64 Allowed Glycine 0 N--CA 1.485 1.912 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' B' ' 62' ' ' ASN . 15.2 pt-20 -141.09 105.74 4.9 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.205 -1.174 . . . . 0.0 109.469 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.488 ' N ' ' HB3' ' B' ' 26' ' ' LYS . 12.2 t -78.59 153.4 31.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.256 -0.902 . . . . 0.0 109.748 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.495 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -110.13 171.16 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.643 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -61.27 -48.95 79.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.155 -0.965 . . . . 0.0 109.973 -179.804 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.582 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 9.4 mp0 -54.84 -40.19 69.35 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 108.953 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.2 mt-10 -78.83 -18.47 53.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.407 -0.808 . . . . 0.0 109.527 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.763 ' CZ ' HD23 ' B' ' 10' ' ' LEU . 3.5 t80 -67.25 -62.14 1.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.181 -0.949 . . . . 0.0 109.046 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.959 ' HB3' ' HB2' ' A' ' 78' ' ' ALA . 1.8 tpp -63.51 -48.04 79.23 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.108 -0.995 . . . . 0.0 108.978 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.684 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -51.54 -36.47 45.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.161 -0.962 . . . . 0.0 108.622 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.757 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.2 OUTLIER -57.86 -62.95 1.44 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.235 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.605 HG21 HD21 ' B' ' 10' ' ' LEU . 3.5 t -49.74 -27.9 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.921 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -58.4 -54.56 45.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.387 -0.821 . . . . 0.0 109.093 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 54.7 mtm -71.47 -68.84 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.365 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.757 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -40.6 -26.48 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 120.602 -1.311 . . . . 0.0 110.036 -179.637 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.517 ' N ' ' O ' ' B' ' 79' ' ' MET . 3.7 m -75.11 -70.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.993 -1.067 . . . . 0.0 108.7 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.7 t -78.08 -49.63 13.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.124 -0.985 . . . . 0.0 108.455 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.78 -44.22 0.72 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.752 -0.592 . . . . 0.0 109.71 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.408 ' O ' ' HB3' ' B' ' 87' ' ' PHE . 0.5 OUTLIER -89.37 -28.86 19.5 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.571 -179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' B' ' 81' ' ' THR . 0.8 OUTLIER -65.54 -70.06 0.26 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -43.95 -28.32 0.45 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.505 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' B' ' 88' ' ' PHE . 11.2 t80 -44.99 -54.04 7.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.202 -0.936 . . . . 0.0 109.417 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.502 ' O ' ' N ' ' B' ' 90' ' ' HIS . 89.3 t80 -43.99 -45.75 7.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' B' ' 86' ' ' GLU . 0.7 OUTLIER -44.18 96.13 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.248 -0.907 . . . . 0.0 109.463 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.502 ' N ' ' O ' ' B' ' 88' ' ' PHE . 0.2 OUTLIER -94.13 147.24 23.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.273 -0.892 . . . . 0.0 109.467 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.456 -179.986 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.544 ' HB2' ' CB ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.805 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.5 OUTLIER -68.28 -79.45 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.821 HD11 HG11 ' B' ' 13' ' ' VAL . 4.9 mp -68.13 -23.04 64.85 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.164 -0.96 . . . . 0.0 109.421 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.544 ' CB ' ' HB2' ' A' ' 1' ' ' SER . 0.2 OUTLIER -63.3 -60.84 2.86 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.23 -0.918 . . . . 0.0 109.229 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 1' ' ' SER . 4.1 tttt -60.73 -29.58 69.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.342 -0.848 . . . . 0.0 109.182 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -71.42 -26.72 62.87 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.34 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.474 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.9 ttm -75.62 -38.71 58.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.332 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.84 -39.49 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.313 -0.867 . . . . 0.0 109.433 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.815 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -72.85 -62.93 1.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 109.508 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.675 ' CD2' HD23 ' B' ' 3' ' ' LEU . 48.7 mt -44.12 -43.69 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.385 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.474 HD12 ' O ' ' A' ' 7' ' ' MET . 62.3 mt -56.75 -53.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.5 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -54.51 -22.78 13.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.942 ' CG1' HD11 ' A' ' 35' ' ' LEU . 4.2 t -82.58 -33.7 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.29 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.547 ' CZ ' ' N ' ' A' ' 70' ' ' PHE . 9.9 t80 -63.12 -47.46 82.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.055 -1.028 . . . . 0.0 109.523 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -80.72 -46.33 15.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 109.712 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -54.52 -62.45 1.65 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 109.669 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.599 ' CD1' HG13 ' A' ' 13' ' ' VAL . 30.2 m-85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.657 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 26.2 m -60.16 -21.43 61.65 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.158 -0.964 . . . . 0.0 109.617 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.66 30.28 10.75 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' CG ' ' HA ' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.01 -50.78 5.82 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -1.17 . . . . 0.0 109.511 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . 81.3 mt-10 -134.72 83.99 2.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.258 -0.901 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.82 -170.81 54.94 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.422 ' O ' ' HD2' ' A' ' 24' ' ' LYS . 88.7 m-20 47.75 -169.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.313 -1.11 . . . . 0.0 109.502 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' C ' ' HB3' ' A' ' 18' ' ' SER . 0.3 OUTLIER -169.31 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.491 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -108.08 16.15 23.61 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.251 -0.906 . . . . 0.0 109.44 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -151.14 170.14 20.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.209 -0.932 . . . . 0.0 109.452 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.8 HD23 ' C ' ' A' ' 31' ' ' GLU . 3.0 mp -108.46 141.22 40.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.88 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.607 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.8 OUTLIER -91.15 79.19 5.77 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 109.079 179.532 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.586 ' CG ' ' CG ' ' A' ' 57' ' ' MET . 0.0 OUTLIER 41.53 -83.03 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.578 -0.701 . . . . 0.0 111.17 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.607 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -49.24 -27.43 3.73 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.669 -1.269 . . . . 0.0 109.711 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.8 ' C ' HD23 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -60.31 -46.19 90.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.916 -1.115 . . . . 0.0 108.617 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.706 ' N ' HD23 ' A' ' 27' ' ' LEU . 7.0 mt -59.75 -51.76 68.39 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 1.007 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -46.36 -36.53 6.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 109.338 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -53.49 43.89 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.592 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.942 HD11 ' CG1' ' A' ' 13' ' ' VAL . 4.7 mt -50.72 -52.52 39.63 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.713 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.027 HG23 HD12 ' A' ' 40' ' ' LEU . 1.9 mp -66.51 -24.59 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.262 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -90.98 -3.72 57.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.222 -0.924 . . . . 0.0 109.615 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -114.05 -14.42 12.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.239 -0.913 . . . . 0.0 109.496 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.742 ' OE1' HD22 ' B' ' 3' ' ' LEU . 5.9 pt-20 -120.94 -14.93 8.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.483 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.117 HD22 HD21 ' A' ' 44' ' ' LEU . 23.8 mt -120.2 75.12 1.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.88 68.12 1.46 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.477 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -51.31 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.496 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.23 -77.1 0.55 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.21 -0.931 . . . . 0.0 109.393 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.117 HD21 HD22 ' A' ' 40' ' ' LEU . 2.4 pp -68.4 112.94 5.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.335 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -125.81 2.75 7.42 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.212 -0.93 . . . . 0.0 109.709 -179.861 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.571 ' OE2' ' CG ' ' A' ' 87' ' ' PHE . 6.1 tt0 -44.42 -37.16 3.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.911 ' CD1' HG21 ' A' ' 36' ' ' ILE . 43.4 mt -63.24 -83.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 109.485 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 7.4 pttm 40.24 28.48 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.636 -0.665 . . . . 0.0 109.877 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.492 ' H ' HG22 ' A' ' 47' ' ' ILE . 5.8 tt0 170.56 -78.83 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -0.873 . . . . 0.0 109.3 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 14.1 pt20 -168.04 26.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.874 . . . . 0.0 109.518 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.25 -69.28 0.3 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.234 -0.916 . . . . 0.0 109.413 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.769 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.6 t -86.67 -21.13 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 109.342 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.007 HG11 ' HG3' ' A' ' 33' ' ' LYS . 41.3 t -77.02 -19.29 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.286 -0.884 . . . . 0.0 109.762 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 53.9 t0 -90.06 -36.5 14.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.181 -0.949 . . . . 0.0 109.598 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -79.74 -38.01 34.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 52' ' ' VAL . 30.8 m -60.43 -43.74 94.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.193 -0.942 . . . . 0.0 109.773 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.586 ' CG ' ' CG ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -39.78 -29.08 0.05 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.078 -1.014 . . . . 0.0 109.488 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.495 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -87.04 -42.56 12.99 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.811 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.908 HG21 ' CE ' ' A' ' 79' ' ' MET . 98.9 m -70.03 -64.92 0.8 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.79 . . . . 0.0 109.587 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.64 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 7.3 mt -38.4 -60.43 0.79 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.474 -0.766 . . . . 0.0 109.589 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.41 112.26 6.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.271 -0.893 . . . . 0.0 109.534 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -120.02 16.67 12.5 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.415 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.24 -47.87 2.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 92.17 2.18 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.89 -35.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -1.126 . . . . 0.0 108.567 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.12 22.83 6.66 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HB2' ' HE2' ' A' ' 26' ' ' LYS . 19.5 pt-20 -128.44 118.54 23.28 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -1.119 . . . . 0.0 109.437 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.82 132.51 46.17 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.25 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 1.2 p30 -104.59 169.62 8.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.301 -0.874 . . . . 0.0 108.97 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.547 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.19 -47.99 54.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.059 -1.026 . . . . 0.0 110.105 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 75' ' ' ALA . 14.1 pt20 -52.48 -37.5 57.35 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.672 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.524 ' OE2' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -82.38 -20.5 37.04 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.065 -1.022 . . . . 0.0 109.775 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 1.6 t80 -66.66 -64.27 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.133 -0.979 . . . . 0.0 109.061 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.867 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.9 -32.82 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.384 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.663 ' HA ' ' HB2' ' B' ' 75' ' ' ALA . . . -65.33 -31.71 72.98 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.263 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.736 ' CZ ' HG21 ' A' ' 56' ' ' VAL . 1.1 t80 -70.44 -59.22 2.98 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.293 -0.879 . . . . 0.0 108.976 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.447 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.4 t -56.57 -25.39 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.989 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.67 -49.2 71.9 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.383 -0.823 . . . . 0.0 109.369 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.908 ' CE ' HG21 ' A' ' 59' ' ' THR . 2.3 mtm -71.94 -70.76 0.31 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.333 -0.855 . . . . 0.0 109.682 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.8 HG11 HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -41.91 -25.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 O-C-N 120.623 -1.298 . . . . 0.0 110.242 -179.187 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.606 HG21 ' HE1' ' B' ' 74' ' ' MET . 3.8 m -74.91 -68.03 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.875 -1.141 . . . . 0.0 108.589 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.8 m -81.68 -51.48 8.15 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.07 -40.64 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.206 0.527 . . . . 0.0 109.913 179.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.486 ' SG ' ' CB ' ' A' ' 46' ' ' GLU . 12.0 t -79.02 -40.89 30.22 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.605 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.2 OUTLIER -64.98 -11.89 43.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.139 -0.975 . . . . 0.0 109.477 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.451 ' OE2' HG23 ' A' ' 82' ' ' THR . 0.5 OUTLIER -90.31 -36.0 14.93 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.571 ' CG ' ' OE2' ' A' ' 46' ' ' GLU . 2.9 m-85 -43.86 -27.06 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 0.0 109.535 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -66.25 -50.81 62.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.272 -0.893 . . . . 0.0 109.376 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.99 172.94 15.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.277 -0.89 . . . . 0.0 109.465 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' O ' ' OXT' ' A' ' 91' ' ' GLU . 26.0 m-70 -81.24 172.97 12.98 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.525 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.422 ' O ' ' OE1' ' A' ' 91' ' ' GLU . 1.9 tm-20 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.815 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 6.4 mm-40 -71.22 -63.47 1.1 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.248 -0.907 . . . . 0.0 109.386 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.76 HD11 ' CD2' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.18 -25.32 63.38 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.43 -65.6 0.67 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.317 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.426 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.1 OUTLIER -62.97 -37.06 85.58 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.273 -0.892 . . . . 0.0 109.25 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -68.71 -17.23 64.03 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.411 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.25 -39.86 20.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.503 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.456 ' O ' HG22 ' B' ' 11' ' ' ILE . 2.4 p -68.97 -31.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.17 -0.956 . . . . 0.0 109.449 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -83.3 -50.42 8.4 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.562 HD12 ' O ' ' B' ' 6' ' ' ALA . 5.4 mt -57.75 -34.71 69.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.794 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -73.26 -47.61 46.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.15 -0.969 . . . . 0.0 109.402 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.576 ' N ' HG23 ' B' ' 11' ' ' ILE . 65.8 t0 -57.34 -19.96 25.83 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.124 -0.985 . . . . 0.0 108.894 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.869 HG22 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -88.14 -41.94 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.37 -0.831 . . . . 0.0 109.632 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.473 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 34.2 t80 -53.93 -42.89 69.3 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.887 -1.133 . . . . 0.0 109.041 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.417 ' O ' ' C ' ' B' ' 16' ' ' GLN . 8.3 t-160 -77.58 -38.65 47.88 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.346 -0.846 . . . . 0.0 109.281 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' B' ' 15' ' ' HIS . 0.9 OUTLIER -44.03 -48.61 8.83 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 108.958 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.869 ' CE2' HG22 ' B' ' 13' ' ' VAL . 12.7 m-85 -92.47 -70.27 0.7 Allowed 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.403 -0.811 . . . . 0.0 109.107 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 4.1 p 38.87 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.594 -0.691 . . . . 0.0 109.99 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 88.12 44.19 5.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.428 ' C ' ' O ' ' B' ' 19' ' ' GLY . 0.1 OUTLIER -42.49 -27.42 0.16 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -1.042 . . . . 0.0 109.625 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.434 ' O ' ' HE2' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -100.05 69.91 1.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.03 -115.51 2.34 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' B' ' 19' ' ' GLY . 70.6 m-20 -61.85 148.61 42.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -1.17 . . . . 0.0 109.551 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.9 tttt -119.29 34.6 5.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.258 -0.901 . . . . 0.0 109.512 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.536 ' HB2' ' CE ' ' B' ' 26' ' ' LYS . 23.7 m-70 -136.98 8.84 3.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.536 ' CE ' ' HB2' ' B' ' 25' ' ' HIS . 0.3 OUTLIER -169.95 156.24 6.03 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.713 ' CD1' HD12 ' B' ' 35' ' ' LEU . 9.8 mt -85.08 147.5 26.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -125.63 85.75 2.44 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.839 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.633 ' HA ' HD12 ' B' ' 32' ' ' LEU . 12.6 tppt? 60.97 -86.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.361 -0.837 . . . . 0.0 110.211 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.508 ' N ' ' HG3' ' B' ' 29' ' ' LYS . 7.2 m -44.04 -52.49 7.07 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.172 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' B' ' 27' ' ' LEU . 0.3 OUTLIER -55.91 -38.42 70.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.12 -0.987 . . . . 0.0 109.469 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 29' ' ' LYS . 36.7 mt -61.25 -70.17 0.2 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.579 -0.701 . . . . 0.0 109.291 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.1 OUTLIER -44.85 -24.61 0.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.687 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.446 ' OE1' ' O ' ' B' ' 30' ' ' SER . 0.1 OUTLIER -71.52 -69.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.134 -0.979 . . . . 0.0 109.537 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.811 HD21 ' CG1' ' B' ' 13' ' ' VAL . 2.4 mt -43.99 -47.91 8.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.305 -0.872 . . . . 0.0 109.732 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.767 ' CG2' HG11 ' B' ' 80' ' ' VAL . 11.6 mm -60.93 -43.07 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.656 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.459 ' HA ' ' HB3' ' B' ' 41' ' ' SER . 13.5 m-80 -90.18 8.38 33.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' B' ' 34' ' ' GLU . 2.1 t30 -94.0 -46.25 7.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.199 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.541 ' OE1' HD13 ' A' ' 3' ' ' LEU . 3.8 mp0 -124.64 -9.9 7.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.896 . . . . 0.0 109.601 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.872 ' HB3' HD21 ' B' ' 44' ' ' LEU . 5.2 mp -112.93 37.38 3.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.203 -0.935 . . . . 0.0 109.496 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' B' ' 37' ' ' ASN . 2.9 p -115.13 10.7 16.16 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.185 -0.947 . . . . 0.0 109.489 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -115.52 -28.8 6.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.209 -0.932 . . . . 0.0 109.474 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -97.57 -72.48 0.64 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.208 -0.933 . . . . 0.0 109.524 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.872 HD21 ' HB3' ' B' ' 40' ' ' LEU . 0.5 OUTLIER -68.58 105.0 2.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.194 -0.942 . . . . 0.0 109.415 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 1.5 pt-20 -98.34 16.4 21.68 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.259 -0.901 . . . . 0.0 109.566 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.45 ' HB2' ' SG ' ' B' ' 84' ' ' CYS . 0.5 OUTLIER -76.14 -49.26 17.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.184 -0.947 . . . . 0.0 109.387 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.962 HD11 ' CG1' ' B' ' 80' ' ' VAL . 43.7 mt -48.83 -92.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.872 . . . . 0.0 109.396 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.512 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.0 mtmt 43.54 27.02 0.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.251 -0.906 . . . . 0.0 109.516 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 170.85 -75.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.409 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' HB ' ' B' ' 53' ' ' VAL . 0.5 OUTLIER -169.62 27.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.218 -0.926 . . . . 0.0 109.553 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.79 -70.24 0.27 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.217 -0.927 . . . . 0.0 109.303 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.979 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.0 t -87.76 -14.72 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.195 -0.941 . . . . 0.0 109.258 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.759 HG23 HD13 ' B' ' 47' ' ' ILE . 43.1 t -77.73 -19.16 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.116 -0.99 . . . . 0.0 109.249 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -90.09 -37.18 14.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.227 -0.921 . . . . 0.0 109.284 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -47.5 20.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.309 -0.869 . . . . 0.0 109.352 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.925 HG11 HG22 ' B' ' 80' ' ' VAL . 31.1 m -55.3 -46.2 78.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.229 -0.919 . . . . 0.0 109.63 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.16 -47.47 6.23 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.204 -0.935 . . . . 0.0 109.887 -179.675 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.17 -56.42 21.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 109.824 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.998 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.7 t -67.64 -9.43 43.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.201 -0.937 . . . . 0.0 109.803 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.83 HD21 ' CD2' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -97.95 -11.47 23.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 0.0 109.52 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.438 ' OD2' ' SD ' ' B' ' 57' ' ' MET . 48.9 m-20 -83.47 114.78 21.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.355 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -101.24 -17.31 16.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.935 . . . . 0.0 109.67 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -141.06 8.97 2.1 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.157 -0.965 . . . . 0.0 109.741 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 71.79 94.48 0.08 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 1.0 OUTLIER 169.22 -28.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.333 -1.098 . . . . 0.0 108.45 -179.831 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.48 -5.69 29.84 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.512 ' HB3' ' CD ' ' B' ' 26' ' ' LYS . 1.8 mm-40 -69.91 110.34 4.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -1.147 . . . . 0.0 109.219 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 14.3 t -87.89 156.49 19.34 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.179 -0.951 . . . . 0.0 109.675 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.452 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.6 OUTLIER -116.33 170.9 8.19 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.733 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.584 ' CZ ' HG12 ' B' ' 11' ' ' ILE . 1.2 t80 -57.73 -51.58 68.97 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.197 -0.94 . . . . 0.0 110.167 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.75 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.0 pt20 -53.81 -44.05 69.87 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.466 -0.771 . . . . 0.0 109.3 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' B' ' 76' ' ' PHE . 3.3 mt-10 -74.05 -19.37 60.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.328 -0.857 . . . . 0.0 109.617 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.537 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 12.6 t80 -65.7 -63.1 1.17 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.244 -0.91 . . . . 0.0 109.178 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.989 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 0.5 OUTLIER -58.65 -46.07 87.93 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.196 -0.94 . . . . 0.0 108.743 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' HA ' ' A' ' 75' ' ' ALA . . . -58.44 -26.53 63.43 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.221 -0.924 . . . . 0.0 108.525 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.83 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.0 OUTLIER -64.17 -69.26 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.511 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.732 HG13 HD11 ' B' ' 40' ' ' LEU . 39.3 t -51.68 -23.65 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.437 -0.789 . . . . 0.0 109.122 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.867 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -63.95 -45.58 88.51 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.289 -0.882 . . . . 0.0 109.304 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.998 ' SD ' HG21 ' B' ' 59' ' ' THR . 42.7 mtm -78.03 -64.35 1.18 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.89 . . . . 0.0 109.677 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.979 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.89 -23.04 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 O-C-N 120.481 -1.387 . . . . 0.0 109.526 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.603 ' OG1' HD21 ' B' ' 40' ' ' LEU . 4.8 m -78.85 -67.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.04 -1.037 . . . . 0.0 109.113 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.2 t -77.1 -49.3 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.0 109.037 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.92 -39.86 0.25 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.747 -0.595 . . . . 0.0 109.966 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' B' ' 44' ' ' LEU . 29.6 t -67.55 -49.38 63.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.242 -0.911 . . . . 0.0 109.554 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -9.93 51.73 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.564 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 87' ' ' PHE . 1.6 tm-20 -89.9 -23.65 21.56 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.229 -0.919 . . . . 0.0 109.525 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' B' ' 86' ' ' GLU . 3.4 t80 -44.15 -44.93 8.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -90.0 -20.37 23.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.895 . . . . 0.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 55.83 -173.2 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.258 -0.901 . . . . 0.0 109.476 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 121.48 24.23 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.468 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 1.2 m . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.615 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -62.1 -39.2 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.257 -0.902 . . . . 0.0 109.612 -179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.782 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.2 mm? -80.56 -28.52 37.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.24 -0.912 . . . . 0.0 109.551 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 8.8 tp10 -64.9 -58.64 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mmtt -65.79 -37.75 87.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.253 -0.904 . . . . 0.0 109.581 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -67.59 -18.45 64.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.617 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.527 ' HG2' HD12 ' A' ' 11' ' ' ILE . 14.4 ttp -82.6 -49.68 9.59 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.928 . . . . 0.0 109.561 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.95 -27.71 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' B' ' 2' ' ' GLU . . . -78.29 -65.63 0.95 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.576 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.66 HD13 ' HG3' ' A' ' 74' ' ' MET . 19.9 mt -49.76 -46.13 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.585 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.527 HD12 ' HG2' ' A' ' 7' ' ' MET . 50.8 mt -58.88 -44.86 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.523 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 26.4 t0 -62.59 -21.42 65.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.935 HG11 HD21 ' B' ' 3' ' ' LEU . 2.8 t -85.25 -26.0 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.2 -0.938 . . . . 0.0 109.425 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 2.9 t80 -72.43 -52.08 17.49 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.974 -1.078 . . . . 0.0 109.285 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.545 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 0.3 OUTLIER -74.48 -30.31 61.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.885 . . . . 0.0 109.635 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 25.3 tt0 -72.4 -63.32 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 0.0 109.603 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.527 ' HA ' ' CD ' ' A' ' 20' ' ' ARG . 11.2 m-85 -56.44 -28.86 60.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.251 -0.905 . . . . 0.0 109.411 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.545 ' HG ' ' HA ' ' A' ' 15' ' ' HIS . 60.8 p -77.59 -31.0 52.73 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.498 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.51 -22.56 63.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 17.3 mtp85 -69.04 -27.6 65.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -1.144 . . . . 0.0 109.453 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.521 ' CG ' ' N ' ' A' ' 22' ' ' GLY . 46.8 tt0 -97.91 165.74 11.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.252 -0.905 . . . . 0.0 109.393 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.521 ' N ' ' CG ' ' A' ' 21' ' ' GLU . . . -43.93 -63.01 2.42 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.01 -177.68 0.28 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.284 -1.127 . . . . 0.0 109.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 15' ' ' HIS . 28.8 mtmt -143.69 45.56 1.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.253 -0.905 . . . . 0.0 109.469 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.437 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t60 -164.91 25.7 0.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 109.455 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.745 ' C ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -170.03 170.21 7.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.264 -0.898 . . . . 0.0 109.486 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 26' ' ' LYS . 9.7 mp -120.49 164.69 16.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.487 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -122.59 69.65 0.98 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.235 -0.916 . . . . 0.0 109.504 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.668 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER 63.05 -83.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.618 -0.676 . . . . 0.0 110.686 179.441 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -46.68 -35.4 5.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.146 -0.971 . . . . 0.0 110.86 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.597 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.7 mp0 -62.64 -42.3 99.52 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 108.851 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.703 HD22 ' CD2' ' A' ' 60' ' ' LEU . 5.1 mt -57.6 -56.62 19.6 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.633 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.5 -45.35 4.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.426 -0.796 . . . . 0.0 109.431 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.422 ' HG2' ' NH2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -63.86 -42.39 97.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.346 -0.846 . . . . 0.0 109.616 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.596 HD21 HG13 ' A' ' 13' ' ' VAL . 18.6 mt -48.18 -60.25 2.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.26 -0.9 . . . . 0.0 109.799 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.842 ' CG2' HD11 ' A' ' 44' ' ' LEU . 1.8 mp -75.55 -16.9 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.308 -0.87 . . . . 0.0 109.729 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.455 HD22 HG12 ' A' ' 47' ' ' ILE . 3.5 m120 -93.62 1.09 56.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.188 -0.945 . . . . 0.0 109.709 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 34' ' ' GLU . 14.7 t30 -117.1 -25.39 7.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.138 -0.977 . . . . 0.0 109.295 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.597 ' HB2' HD12 ' B' ' 3' ' ' LEU . 68.8 mm-40 -126.58 -10.14 6.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.901 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.825 ' HB3' HD21 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -120.08 56.61 0.96 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.042 -1.036 . . . . 0.0 109.489 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 63.7 p -112.97 11.23 19.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.301 -0.874 . . . . 0.0 109.385 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -104.27 -39.23 6.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 109.422 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.62 ' CE1' ' NE2' ' A' ' 85' ' ' HIS . 1.7 m-85 -88.49 -66.05 0.96 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.902 . . . . 0.0 109.46 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.842 HD11 ' CG2' ' A' ' 36' ' ' ILE . 0.3 OUTLIER -80.94 6.35 13.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.518 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' A' ' 41' ' ' SER . 3.5 mp0 51.14 -91.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.211 -0.931 . . . . 0.0 109.574 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 44' ' ' LEU . 22.6 pt-20 -135.83 177.39 7.87 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.438 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.73 HG13 HG21 ' A' ' 53' ' ' VAL . 8.2 mm -81.15 135.62 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.476 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.6 mttt -86.27 61.82 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.252 -0.905 . . . . 0.0 109.251 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.5 OUTLIER 83.29 -42.49 0.1 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 109.647 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.49 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 2.1 mt-30 167.43 57.95 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.093 -1.004 . . . . 0.0 109.341 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 2.0 tt0 -89.29 -70.34 0.66 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.157 -0.964 . . . . 0.0 109.587 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.788 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.1 t -90.54 -20.74 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.113 -0.992 . . . . 0.0 109.238 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.73 HG21 HG13 ' A' ' 47' ' ' ILE . 24.9 t -77.22 -29.11 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.156 -0.965 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 0.5 OUTLIER -90.12 -32.41 16.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.38 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 1.1 tmtp? -75.88 -37.76 58.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.407 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 1.013 ' HB ' HD13 ' A' ' 60' ' ' LEU . 8.8 m -56.35 -53.2 42.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.211 -0.93 . . . . 0.0 109.748 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.592 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -40.16 -28.91 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.155 -0.966 . . . . 0.0 109.53 -179.713 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -75.03 -50.54 16.18 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.468 HG21 ' SD ' ' A' ' 79' ' ' MET . 14.3 m -79.19 -64.8 1.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 108.794 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.108 HD21 ' CG ' ' A' ' 76' ' ' PHE . 4.2 mp -38.09 -47.82 1.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.708 -0.62 . . . . 0.0 109.756 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 57' ' ' MET . 0.5 OUTLIER -88.3 86.9 7.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.54 -7.64 7.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.513 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -78.27 -41.7 33.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.488 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.46 2.12 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -177.28 -35.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.244 -1.151 . . . . 0.0 108.593 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.35 -13.38 36.51 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.485 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 8.5 mt-10 -108.67 147.38 31.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -1.13 . . . . 0.0 109.515 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.52 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 1.9 t -69.79 147.74 50.04 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.307 -0.87 . . . . 0.0 109.601 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -116.63 170.98 8.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.513 -0.742 . . . . 0.0 109.359 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -61.45 -52.05 66.16 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.346 -0.847 . . . . 0.0 110.453 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -51.94 -39.32 59.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.327 -0.858 . . . . 0.0 109.548 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.52 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 1.6 pt-20 -79.6 -22.58 43.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.157 -0.965 . . . . 0.0 109.637 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.411 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 10.8 t80 -62.28 -59.53 4.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 109.003 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.845 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 2.4 ttm -65.22 -44.8 87.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.314 -0.867 . . . . 0.0 109.1 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.24 -22.17 62.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.009 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 1.108 ' CG ' HD21 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.48 -63.59 1.09 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.815 . . . . 0.0 108.838 179.704 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.705 HG13 HD11 ' A' ' 40' ' ' LEU . 42.0 t -56.52 -23.1 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -63.48 -49.97 71.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.499 -0.751 . . . . 0.0 109.065 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.696 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 39.1 mtp -72.77 -70.11 0.37 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.388 -0.82 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -41.25 -25.84 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 120.575 -1.328 . . . . 0.0 110.02 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . 1.018 HG21 HD11 ' B' ' 11' ' ' ILE . 4.6 m -77.67 -69.96 0.51 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.936 -1.102 . . . . 0.0 108.629 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -77.8 -49.91 13.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.093 -1.004 . . . . 0.0 108.325 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.25 -48.21 1.77 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.371 0.605 . . . . 0.0 109.453 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 44' ' ' LEU . 13.4 t -61.03 -46.3 91.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.317 -0.864 . . . . 0.0 109.403 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.62 ' NE2' ' CE1' ' A' ' 43' ' ' PHE . 3.4 m-70 -68.43 -11.19 59.34 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.456 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' A' ' 87' ' ' PHE . 4.8 tp10 -86.99 -37.26 17.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.4 ' C ' ' O ' ' A' ' 86' ' ' GLU . 49.2 t80 -44.98 -26.21 0.4 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 109.395 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -68.09 0.5 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.21 167.5 21.79 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.238 -0.914 . . . . 0.0 109.42 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -139.64 131.46 27.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.219 -0.926 . . . . 0.0 109.436 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.456 179.966 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.553 ' HB3' ' N ' ' B' ' 5' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.487 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 2.5 mp0 39.23 -93.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.577 -0.702 . . . . 0.0 110.249 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.935 HD21 HG11 ' A' ' 13' ' ' VAL . 20.5 mt -75.83 -50.41 15.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.932 . . . . 0.0 109.43 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' B' ' 1' ' ' SER . 0.9 OUTLIER -49.87 -34.54 20.43 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.176 -0.952 . . . . 0.0 109.023 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.553 ' N ' ' HB3' ' B' ' 1' ' ' SER . 0.5 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.256 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.493 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -66.15 -10.0 36.91 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 109.339 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.734 ' O ' HD12 ' B' ' 11' ' ' ILE . 4.0 mtp -80.5 -57.71 3.46 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.267 -0.895 . . . . 0.0 109.392 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 16.5 t -64.23 -32.71 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.3 -0.875 . . . . 0.0 109.351 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.615 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -70.19 -68.9 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.333 -0.854 . . . . 0.0 109.561 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 1.048 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -51.3 -60.39 3.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.255 -0.903 . . . . 0.0 109.493 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 81' ' ' THR . 28.2 mt -42.86 -41.06 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -59.12 -47.92 83.49 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.364 -0.835 . . . . 0.0 109.659 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.946 HG22 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -61.23 -34.05 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.137 -0.977 . . . . 0.0 109.673 -179.616 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.59 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 9.1 t80 -60.11 -70.32 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.045 -1.034 . . . . 0.0 109.159 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -64.79 -9.82 23.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.723 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.501 ' HB3' ' HA ' ' B' ' 13' ' ' VAL . 56.7 tp60 -75.49 -69.93 0.45 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.834 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 1.169 ' CE2' HD23 ' B' ' 35' ' ' LEU . 0.0 OUTLIER -100.26 21.37 13.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.145 -0.972 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.602 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.5 t -80.86 -19.9 43.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 109.328 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.508 ' CA ' ' HA ' ' B' ' 24' ' ' LYS . . . -103.1 8.71 53.94 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.471 ' HG2' ' CA ' ' B' ' 17' ' ' TYR . 22.1 mmt180 -52.89 -54.28 36.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -1.177 . . . . 0.0 109.449 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' CE ' ' B' ' 28' ' ' LYS . 1.0 OUTLIER -127.91 103.55 7.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.57 -147.48 16.42 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.47 ' O ' ' HA2' ' B' ' 19' ' ' GLY . 0.2 OUTLIER -71.41 167.28 19.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.249 -1.147 . . . . 0.0 109.474 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.508 ' HA ' ' CA ' ' B' ' 19' ' ' GLY . 3.5 mttp -104.93 40.85 1.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.924 . . . . 0.0 109.496 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -134.17 11.39 3.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.226 -0.921 . . . . 0.0 109.437 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.5 OUTLIER -161.71 169.99 20.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.458 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.804 HD13 ' OH ' ' B' ' 17' ' ' TYR . 59.1 mt -120.61 141.01 50.73 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.707 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.52 ' CE ' ' O ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -87.25 165.72 15.46 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.489 ' N ' ' HD3' ' B' ' 29' ' ' LYS . 6.8 mmtp -42.72 -31.86 0.52 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.267 -0.896 . . . . 0.0 109.011 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 30.6 p -73.5 -58.0 3.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.443 -0.786 . . . . 0.0 110.189 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.798 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.6 mp0 -45.61 -44.32 12.97 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.047 -1.033 . . . . 0.0 109.117 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' B' ' 27' ' ' LEU . 24.7 mt -54.09 -62.74 1.46 Allowed 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.636 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.2 OUTLIER -47.26 -23.17 0.5 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.893 . . . . 0.0 110.072 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 30' ' ' SER . 23.2 mm-40 -75.82 -70.28 0.44 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.976 -1.078 . . . . 0.0 109.99 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 1.169 HD23 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -42.98 -33.03 0.72 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.414 -0.804 . . . . 0.0 109.634 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.979 HD13 HG11 ' B' ' 80' ' ' VAL . 14.5 mt -72.5 -45.24 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.152 -0.967 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.476 ' OD1' ' HG2' ' B' ' 46' ' ' GLU . 1.9 m-80 -72.6 -9.36 58.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.539 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.56 -51.21 7.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.913 . . . . 0.0 109.369 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 3' ' ' LEU . 1.3 tt0 -102.67 -43.43 5.6 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.0 109.348 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' B' ' 36' ' ' ILE . 1.0 OUTLIER -86.63 58.75 5.24 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 109.484 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' B' ' 37' ' ' ASN . 6.8 p -116.95 36.5 4.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.439 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.1 -35.96 1.56 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.233 -0.917 . . . . 0.0 109.451 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.09 -28.95 8.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 109.497 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.812 HD13 ' HB3' ' B' ' 40' ' ' LEU . 8.2 mp -75.93 -15.64 60.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 0.0 109.492 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 46' ' ' GLU . 15.2 mt-10 50.63 59.94 4.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.516 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.476 ' HG2' ' OD1' ' B' ' 37' ' ' ASN . 2.9 mt-10 43.94 41.1 3.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.272 -0.893 . . . . 0.0 109.482 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.861 HG13 HG21 ' B' ' 53' ' ' VAL . 1.8 mm 48.25 95.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.242 -0.911 . . . . 0.0 109.293 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.522 ' NZ ' ' HG3' ' B' ' 51' ' ' GLU . 9.8 pttt -43.26 -45.51 5.83 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.238 -0.914 . . . . 0.0 109.544 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.476 ' CG ' ' C ' ' B' ' 48' ' ' LYS . 7.1 mt-10 -154.83 -39.65 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.875 . . . . 0.0 109.301 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 167.72 58.97 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.319 -0.863 . . . . 0.0 109.383 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.522 ' HG3' ' NZ ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -86.45 -70.29 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.34 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.92 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -87.78 -27.11 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.929 . . . . 0.0 109.047 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.861 HG21 HG13 ' B' ' 47' ' ' ILE . 54.5 t -68.18 -20.42 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.306 -0.871 . . . . 0.0 109.042 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 4.8 t0 -90.16 -51.37 5.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.354 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -58.06 -33.88 69.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 52' ' ' VAL . 25.3 m -58.56 -50.82 77.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.168 -0.957 . . . . 0.0 109.519 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.603 ' HE1' HD11 ' B' ' 32' ' ' LEU . 0.8 OUTLIER -44.91 -26.25 0.39 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.923 -1.11 . . . . 0.0 109.373 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' B' ' 56' ' ' VAL . 9.8 mt-10 -74.9 -47.08 31.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.264 -0.897 . . . . 0.0 108.978 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.464 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 45.0 m -85.01 -63.47 1.32 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.274 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.949 HD21 ' CD1' ' B' ' 76' ' ' PHE . 10.7 mp -38.33 -32.99 0.08 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.608 -0.682 . . . . 0.0 109.902 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.456 ' OD2' ' O ' ' B' ' 57' ' ' MET . 76.0 m-20 -90.15 112.35 23.81 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.182 -0.949 . . . . 0.0 109.553 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.464 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -124.95 -29.3 3.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.225 -0.922 . . . . 0.0 109.641 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.401 ' OD1' ' HG3' ' B' ' 67' ' ' GLU . 1.4 p30 -82.17 -12.18 58.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.225 -0.922 . . . . 0.0 109.612 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 70.08 85.92 0.14 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 12.9 t0 178.14 -32.32 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.321 -1.105 . . . . 0.0 108.678 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.489 ' HA2' ' HE2' ' B' ' 29' ' ' LYS . . . 110.36 38.22 1.67 Allowed Glycine 0 N--CA 1.485 1.938 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -135.42 119.52 17.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.337 -1.096 . . . . 0.0 109.335 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.473 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 16.4 t -69.73 156.96 38.2 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 0.0 109.854 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.504 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -120.64 171.77 8.34 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.709 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -62.6 -50.94 69.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.353 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.414 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.8 pt20 -55.45 -40.18 71.25 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.139 -0.975 . . . . 0.0 108.944 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.8 OUTLIER -78.95 -17.9 54.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.314 -0.866 . . . . 0.0 109.184 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 1.048 ' CE2' HD23 ' B' ' 10' ' ' LEU . 5.3 t80 -65.41 -57.34 8.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.877 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -64.01 -42.13 97.24 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.011 -1.056 . . . . 0.0 108.408 179.136 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -67.64 -16.34 64.11 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.335 -0.853 . . . . 0.0 108.798 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.949 ' CD1' HD21 ' B' ' 60' ' ' LEU . 2.1 t80 -71.8 -62.63 1.35 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.466 ' HA ' HG23 ' B' ' 80' ' ' VAL . 75.2 t -62.0 -26.77 40.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.845 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -60.77 -44.72 96.4 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.39 -0.819 . . . . 0.0 109.099 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.677 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 12.8 mtp -73.67 -69.88 0.41 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.276 -0.89 . . . . 0.0 109.155 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.979 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -41.86 -26.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.7 -1.25 . . . . 0.0 109.615 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.502 ' N ' ' O ' ' B' ' 79' ' ' MET . 12.5 m -75.64 -70.09 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.043 -1.036 . . . . 0.0 108.868 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.569 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.9 t -78.07 -49.45 13.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.121 -0.987 . . . . 0.0 108.574 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.31 -41.53 0.63 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.257 0.551 . . . . 0.0 109.856 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.94 -36.45 27.98 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 109.649 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.8 t-160 -67.96 -9.95 49.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.165 -0.959 . . . . 0.0 109.658 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.514 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 1.4 pp20? -80.64 -13.43 59.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 109.61 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -52.12 -20.86 2.77 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.168 -0.957 . . . . 0.0 109.545 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.12 -69.44 0.37 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 109.458 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' B' ' 90' ' ' HIS . 1.0 OUTLIER -113.95 -148.91 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' B' ' 89' ' ' GLU . 0.5 OUTLIER 60.97 87.66 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.462 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.445 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.461 ' CB ' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.759 ' OE1' ' HB1' ' B' ' 9' ' ' ALA . 0.2 OUTLIER -63.9 -71.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.784 HD21 ' HZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -68.72 -24.54 64.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.538 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.461 ' HB2' ' CB ' ' A' ' 1' ' ' SER . 0.2 OUTLIER -59.67 -52.8 63.94 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.457 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -65.86 -48.89 70.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -60.81 -17.47 49.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.9 ttp -77.68 -61.43 1.99 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.197 -0.939 . . . . 0.0 109.54 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -49.69 -34.2 8.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.258 -0.902 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -66.4 0.56 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.506 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.47 ' HG ' HD22 ' B' ' 3' ' ' LEU . 0.3 OUTLIER -45.42 -25.73 0.46 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.905 HD13 ' HZ ' ' A' ' 70' ' ' PHE . 17.7 mm -68.93 -53.85 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.267 -0.896 . . . . 0.0 109.498 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.53 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 7.4 t0 -61.48 -18.73 60.35 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.31 -0.869 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.703 HG11 HD11 ' B' ' 3' ' ' LEU . 2.1 t -87.67 -28.84 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.254 -0.904 . . . . 0.0 109.374 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 5.1 t80 -70.05 -46.53 64.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.018 -1.051 . . . . 0.0 109.339 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.456 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 15.1 t-80 -80.5 -34.53 35.67 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.329 -0.857 . . . . 0.0 109.711 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 46.9 tt0 -65.17 -57.74 7.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.2 -0.938 . . . . 0.0 109.606 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.628 ' HE1' HG22 ' A' ' 13' ' ' VAL . 50.6 m-85 -65.45 -33.51 76.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.899 . . . . 0.0 109.569 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.535 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 59.9 p -82.23 0.96 38.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.216 -0.927 . . . . 0.0 109.698 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.94 -22.86 75.95 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 5.2 mtt-85 -77.03 -15.47 59.6 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.261 -1.141 . . . . 0.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -93.52 168.2 11.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 109.439 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -72.73 -38.1 57.07 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 1.8 m-20 -62.47 -34.92 77.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.126 . . . . 0.0 109.439 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 16.6 mtpt 74.97 0.82 3.64 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.579 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -138.11 7.42 2.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.0 109.573 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.535 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.0 OUTLIER -137.83 142.98 40.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.205 -0.934 . . . . 0.0 109.437 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.843 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.7 mp -86.85 161.15 18.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.171 -0.956 . . . . 0.0 109.51 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.52 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -126.59 73.73 1.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.291 -0.881 . . . . 0.0 109.279 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.636 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.6 tttm 63.71 -84.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.607 -0.683 . . . . 0.0 110.267 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 m -44.69 -48.24 10.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.168 -0.957 . . . . 0.0 110.535 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.843 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -56.62 -39.86 74.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.926 -1.109 . . . . 0.0 109.358 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.925 HD22 HD23 ' A' ' 60' ' ' LEU . 25.0 mt -60.88 -65.81 0.63 Allowed 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.542 -0.724 . . . . 0.0 109.208 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.575 ' HG3' HG11 ' A' ' 53' ' ' VAL . 3.7 ttpt -42.74 -27.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.346 -0.846 . . . . 0.0 109.527 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -67.22 -63.98 0.95 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.211 -0.931 . . . . 0.0 109.353 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.594 ' CD2' HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -44.32 -32.91 1.45 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.879 . . . . 0.0 109.528 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.681 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -70.13 -49.89 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.937 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HD11 ' A' ' 47' ' ' ILE . 2.7 m-20 -86.96 11.91 12.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 109.659 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.417 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 8.8 t-20 -109.46 -40.96 4.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.163 -0.961 . . . . 0.0 109.517 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.628 ' HG2' HD12 ' B' ' 3' ' ' LEU . 0.0 OUTLIER -121.61 -22.53 5.84 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.631 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.025 HD22 HD21 ' A' ' 44' ' ' LEU . 16.9 mt -97.18 33.4 1.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.144 -0.973 . . . . 0.0 109.438 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t -88.7 -8.56 54.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.457 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -87.25 -66.16 0.94 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.917 . . . . 0.0 109.506 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.522 ' CE1' ' NE2' ' A' ' 85' ' ' HIS . 2.4 m-85 -59.5 -93.45 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.245 -0.91 . . . . 0.0 109.434 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.025 HD21 HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -49.02 -43.16 40.26 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.161 -0.962 . . . . 0.0 109.318 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.524 ' CG ' ' O ' ' A' ' 44' ' ' LEU . 9.0 pt-20 41.54 27.86 0.07 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.431 -0.793 . . . . 0.0 109.763 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 2.3 tp10 176.7 101.05 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.195 -0.941 . . . . 0.0 109.427 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 1.008 HD13 HG21 ' A' ' 53' ' ' VAL . 33.0 mt -60.94 -18.46 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.213 -0.929 . . . . 0.0 109.529 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.2 mtmt 75.16 26.28 1.24 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.277 -0.89 . . . . 0.0 109.322 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 tt0 83.33 -43.38 0.1 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.693 -0.629 . . . . 0.0 109.802 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.418 ' CD ' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -178.15 54.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.075 -1.015 . . . . 0.0 109.499 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 48' ' ' LYS . 50.2 tp10 -90.03 -70.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.487 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.787 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.7 t -90.97 -16.12 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.173 -0.954 . . . . 0.0 109.316 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.008 HG21 HD13 ' A' ' 47' ' ' ILE . 41.2 t -80.76 -24.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.0 108.96 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.82 -33.07 21.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 109.119 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -41.97 26.83 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.35 -0.844 . . . . 0.0 109.293 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.958 ' HB ' HD13 ' A' ' 60' ' ' LEU . 28.6 m -58.81 -49.24 83.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 O-C-N 121.251 -0.906 . . . . 0.0 109.493 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.581 ' N ' HG23 ' A' ' 56' ' ' VAL . 4.3 tpt -42.97 -27.01 0.16 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.505 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 56' ' ' VAL . 2.0 tm-20 -79.04 -45.68 19.67 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.266 -0.897 . . . . 0.0 109.114 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 60' ' ' LEU . 22.3 m -79.03 -63.48 1.41 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 109.505 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.958 HD13 ' HB ' ' A' ' 56' ' ' VAL . 7.6 mp -37.92 -43.85 0.73 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.613 -0.679 . . . . 0.0 109.955 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.491 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 8.0 m-20 -90.11 69.99 7.29 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.159 -0.963 . . . . 0.0 109.453 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -95.69 -9.4 32.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' O ' ' A' ' 67' ' ' GLU . 2.7 p-10 -78.86 -13.45 59.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.182 -0.948 . . . . 0.0 109.503 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 65.26 83.86 0.09 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 13.5 t0 177.63 -32.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.206 -1.173 . . . . 0.0 108.658 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.24 36.57 1.94 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' OD1' ' A' ' 63' ' ' ASP . 39.5 mt-10 -148.94 124.18 10.19 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.299 -1.118 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.527 ' O ' ' CD ' ' A' ' 26' ' ' LYS . 14.0 t -69.9 155.23 40.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.199 -0.938 . . . . 0.0 109.659 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.491 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -115.47 171.27 7.82 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 179.679 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.905 ' HZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -60.77 -49.73 76.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 110.149 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' B' ' 79' ' ' MET . 50.4 mt-30 -54.72 -43.42 72.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 108.997 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.491 ' HG3' ' HB2' ' A' ' 69' ' ' ASP . 1.4 mt-10 -76.78 -16.95 59.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.392 -0.818 . . . . 0.0 109.649 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.615 ' CE2' HG12 ' A' ' 13' ' ' VAL . 13.7 t80 -71.08 -52.92 16.67 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.049 -1.032 . . . . 0.0 109.161 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.857 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.6 OUTLIER -65.14 -42.23 94.03 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.162 -0.961 . . . . 0.0 108.785 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -66.7 -25.17 66.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 108.734 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.833 ' CG ' HD21 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.21 -63.0 1.26 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.74 HG12 ' HE1' ' B' ' 7' ' ' MET . 96.9 t -62.59 -25.4 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.313 -0.867 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.85 -29.08 67.33 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.455 -0.778 . . . . 0.0 109.065 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.702 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 19.5 mtp -84.59 -70.88 0.55 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.31 -0.869 . . . . 0.0 109.188 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.924 ' HB ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -44.9 -25.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 O-C-N 120.416 -1.428 . . . . 0.0 109.458 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . 1.001 HG21 ' SD ' ' B' ' 7' ' ' MET . 41.7 m -81.75 -63.71 1.33 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 108.499 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.657 HG21 ' CB ' ' B' ' 70' ' ' PHE . 2.0 m -79.91 -54.6 5.66 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.702 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.51 -43.7 0.41 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.321 0.581 . . . . 0.0 109.753 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -71.14 -45.16 64.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.405 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.522 ' NE2' ' CE1' ' A' ' 43' ' ' PHE . 1.9 m-70 -62.43 -13.64 32.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.234 -0.916 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.88 -48.09 17.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.411 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -59.09 -26.82 64.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.23 -0.919 . . . . 0.0 109.416 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.77 -38.56 56.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 0.0 109.439 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.53 -68.51 0.47 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.202 -0.937 . . . . 0.0 109.446 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.403 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 15.2 t-80 53.17 44.6 30.06 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.233 -0.917 . . . . 0.0 109.457 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.479 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.427 ' N ' ' HB3' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' B' ' 2' ' ' GLU . 1.1 tp10 -64.76 -76.46 0.07 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.249 -0.907 . . . . 0.0 109.444 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.703 HD11 HG11 ' A' ' 13' ' ' VAL . 12.1 mt -69.73 -21.4 63.46 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -0.936 . . . . 0.0 109.438 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.427 ' HB3' ' N ' ' B' ' 1' ' ' SER . 2.9 tt0 -63.92 -51.7 63.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 109.396 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -43.02 71.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.894 . . . . 0.0 109.4 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -71.7 -12.3 61.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' MET . . . . . 1.001 ' SD ' HG21 ' A' ' 81' ' ' THR . 16.7 tpp -83.71 -45.17 13.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 53.2 t -68.63 -34.15 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.759 ' HB1' ' OE1' ' A' ' 2' ' ' GLU . . . -72.07 -58.48 3.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.736 HD12 ' HB1' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -51.95 -55.24 21.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.262 -0.899 . . . . 0.0 109.476 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.699 HD11 ' CG2' ' A' ' 81' ' ' THR . 21.1 mt -47.85 -46.48 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.875 . . . . 0.0 109.5 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' B' ' 16' ' ' GLN . 5.0 t0 -56.63 -42.78 79.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.886 . . . . 0.0 109.549 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 3' ' ' LEU . 2.2 t -64.27 -25.51 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.243 -0.911 . . . . 0.0 109.572 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 31.1 t80 -72.05 -40.26 68.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.938 -1.101 . . . . 0.0 109.596 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.583 ' CE1' ' HG2' ' B' ' 24' ' ' LYS . 18.1 t60 -74.03 -38.2 64.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.915 . . . . 0.0 110.271 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -74.67 -59.62 2.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.68 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.593 ' CD1' HG13 ' B' ' 13' ' ' VAL . 15.6 m-85 -55.01 -31.89 61.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.323 -0.86 . . . . 0.0 109.496 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.563 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.5 p -86.6 -22.02 26.47 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.201 -0.937 . . . . 0.0 109.51 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -83.56 -13.59 75.55 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 37.6 mtp85 -64.17 -61.88 1.97 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -1.19 . . . . 0.0 109.46 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -133.77 124.98 27.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.66 -108.31 0.82 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -150.8 27.6 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -1.113 . . . . 0.0 109.479 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.583 ' HG2' ' CE1' ' B' ' 15' ' ' HIS . 0.0 OUTLIER 53.82 61.1 3.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 109.464 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.575 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 2.2 m170 -170.14 -35.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.585 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.579 ' CB ' ' CB ' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -129.19 170.35 13.67 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.56 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 31' ' ' GLU . 70.1 mt -119.09 136.97 53.88 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.218 -0.926 . . . . 0.0 110.022 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.46 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -86.6 165.96 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.514 ' CG ' ' SD ' ' B' ' 57' ' ' MET . 0.1 OUTLIER -42.84 -26.94 0.15 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.982 . . . . 0.0 109.87 -179.708 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -78.65 -49.38 13.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.208 -0.932 . . . . 0.0 110.411 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.836 ' HB3' HD22 ' B' ' 27' ' ' LEU . 37.1 mm-40 -55.98 -41.85 75.43 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.982 -1.074 . . . . 0.0 108.663 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.906 HD22 HD12 ' B' ' 60' ' ' LEU . 2.1 mt -57.61 -65.98 0.54 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.792 -0.568 . . . . 0.0 109.615 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.34 -30.96 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.367 -0.833 . . . . 0.0 109.648 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -67.91 0.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.923 . . . . 0.0 109.301 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.758 ' CD1' HD13 ' B' ' 27' ' ' LEU . 12.1 mt -45.72 -25.46 0.49 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 109.547 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.691 HD12 ' O ' ' B' ' 32' ' ' LEU . 0.7 OUTLIER -70.84 -59.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 108.91 179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' B' ' 42' ' ' HIS . 51.2 m-80 -78.89 4.83 13.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 109.708 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -119.07 -11.11 9.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.399 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.879 ' OE1' HG13 ' B' ' 77' ' ' VAL . 5.4 tm-20 -101.94 -40.74 6.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 0.0 109.4 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.878 ' HB2' HD22 ' B' ' 44' ' ' LEU . 2.7 mm? -88.22 -46.72 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.255 -0.903 . . . . 0.0 109.393 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.0 t 162.31 -89.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.382 -0.824 . . . . 0.0 109.261 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.514 ' HB3' ' CD2' ' B' ' 43' ' ' PHE . 3.4 m170 -125.02 -47.74 1.77 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.309 -0.869 . . . . 0.0 109.252 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.514 ' CD2' ' HB3' ' B' ' 42' ' ' HIS . 3.9 p90 -151.28 18.34 0.74 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.346 -0.846 . . . . 0.0 109.325 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.878 HD22 ' HB2' ' B' ' 40' ' ' LEU . 0.1 OUTLIER 34.48 39.54 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.859 -0.526 . . . . 0.0 110.275 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.44 ' C ' ' O ' ' B' ' 44' ' ' LEU . 0.2 OUTLIER 42.99 59.65 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.217 -0.927 . . . . 0.0 109.483 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 6.1 tt0 174.84 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.324 -0.86 . . . . 0.0 109.3 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.704 HG13 HD21 ' B' ' 44' ' ' LEU . 14.0 mm -47.47 -90.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.188 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 6.2 mtmt 83.37 -60.12 0.13 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.639 -0.663 . . . . 0.0 109.973 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' HG2' ' B' ' 50' ' ' GLN . 5.4 pt-20 -143.88 -46.55 0.27 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.057 -1.027 . . . . 0.0 109.637 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -164.93 31.05 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.955 . . . . 0.0 109.721 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.15 -70.4 0.24 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -1.0 . . . . 0.0 109.082 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.991 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.1 t -84.11 -9.61 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.0 109.037 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HG3' ' B' ' 33' ' ' LYS . 2.2 t -82.5 -31.61 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.065 -1.022 . . . . 0.0 109.099 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 1.4 t70 -90.33 -29.57 18.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.411 -0.806 . . . . 0.0 109.191 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -84.39 -44.64 13.54 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.332 -0.855 . . . . 0.0 109.398 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 1.109 HG22 HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -68.2 -42.84 85.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 O-C-N 121.125 -0.984 . . . . 0.0 109.314 179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.514 ' SD ' ' CG ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -39.88 -55.0 2.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 110.318 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -58.44 -40.65 83.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.954 . . . . 0.0 109.323 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.678 HG21 ' SD ' ' B' ' 79' ' ' MET . 99.4 m -67.61 -20.2 65.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 110.356 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 1.109 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -82.2 -72.48 0.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.932 -1.105 . . . . 0.0 109.151 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.26 100.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 0.0 109.496 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.92 9.08 4.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.275 -0.891 . . . . 0.0 109.545 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.91 -29.78 9.27 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.936 . . . . 0.0 109.405 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.76 2.13 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -175.26 -36.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.257 -1.143 . . . . 0.0 108.521 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 -12.9 50.68 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.579 ' CB ' ' CB ' ' B' ' 26' ' ' LYS . 1.7 mm-40 -112.24 150.54 30.77 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.257 -1.143 . . . . 0.0 109.457 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.903 ' SG ' HD21 ' B' ' 32' ' ' LEU . 7.2 m -73.74 155.77 38.58 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.203 -0.936 . . . . 0.0 110.199 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.41 171.5 7.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.481 -0.762 . . . . 0.0 109.196 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.688 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -57.88 -53.63 56.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.238 -0.914 . . . . 0.0 110.672 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.495 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 1.9 pt20 -62.31 -29.99 70.83 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.23 -0.919 . . . . 0.0 108.687 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.486 ' HG2' ' HB3' ' B' ' 68' ' ' CYS . 1.1 tt0 -81.78 -15.25 54.86 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.784 ' HZ ' HD21 ' A' ' 3' ' ' LEU . 5.7 t80 -75.35 -52.3 11.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.185 -0.947 . . . . 0.0 108.938 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.819 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -66.64 -45.82 77.78 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.891 . . . . 0.0 109.188 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.09 -43.41 91.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 108.922 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.668 ' CE1' HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -49.15 -60.11 3.08 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.879 HG13 ' OE1' ' B' ' 39' ' ' GLU . 44.0 t -59.92 -25.57 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.342 -0.848 . . . . 0.0 108.714 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.857 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -60.86 -37.31 81.69 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.52 -0.737 . . . . 0.0 109.207 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.704 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 1.1 mtm -79.11 -66.79 0.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.991 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -47.95 -22.43 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 O-C-N 120.473 -1.392 . . . . 0.0 109.218 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 16.3 m -78.42 -66.44 0.85 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.059 -1.026 . . . . 0.0 108.915 178.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.8 t -81.37 -49.84 10.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.995 . . . . 0.0 108.756 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.85 -35.92 0.17 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.807 -0.558 . . . . 0.0 109.605 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' B' ' 44' ' ' LEU . 10.0 t -67.07 -52.89 36.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.367 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.49 -10.4 51.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.225 -0.922 . . . . 0.0 109.543 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -90.14 -34.56 15.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.193 -0.942 . . . . 0.0 109.493 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.65 -33.07 70.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.901 . . . . 0.0 109.483 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -47.49 -65.99 0.48 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.241 -0.912 . . . . 0.0 109.493 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.52 174.74 13.61 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.247 -0.908 . . . . 0.0 109.464 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.438 ' O ' ' O ' ' B' ' 91' ' ' GLU . 0.4 OUTLIER 61.6 95.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.255 -0.903 . . . . 0.0 109.504 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.438 ' O ' ' O ' ' B' ' 90' ' ' HIS . 39.2 mt-10 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.497 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.659 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.3 mp0 -73.96 -71.24 0.34 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.299 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.769 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.4 mp -61.48 -18.02 57.15 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.342 -0.849 . . . . 0.0 109.404 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.456 ' O ' ' CG ' ' A' ' 7' ' ' MET . 5.2 tt0 -68.89 -66.98 0.51 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.074 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.523 ' HA ' HG22 ' A' ' 8' ' ' VAL . 2.5 ttmt -65.49 -14.59 61.33 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.278 -0.889 . . . . 0.0 109.055 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.753 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -82.81 -29.4 29.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.332 -0.855 . . . . 0.0 109.117 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 8' ' ' VAL . 3.7 ptp -83.33 -23.77 32.39 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 109.251 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.554 HG23 ' N ' ' A' ' 9' ' ' ALA . 32.9 m -80.39 -44.33 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.261 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -71.23 -36.38 71.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.456 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.837 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -75.15 -54.18 7.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 109.626 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.837 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -46.62 -45.86 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.098 -1.001 . . . . 0.0 109.352 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.552 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -67.8 -34.17 76.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.192 -0.942 . . . . 0.0 109.583 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.03 HG11 HD21 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -73.97 -15.42 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.2 t80 -85.78 -41.88 14.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.01 -1.056 . . . . 0.0 109.281 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.459 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 10.6 m170 -74.47 -28.91 61.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.284 -0.885 . . . . 0.0 109.352 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -79.74 -60.29 2.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.911 . . . . 0.0 109.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.574 ' HB3' HD21 ' A' ' 27' ' ' LEU . 37.9 m-85 -59.0 -46.09 89.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.497 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 p -75.05 -11.94 60.21 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 109.481 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.545 ' HA3' ' CG ' ' A' ' 24' ' ' LYS . . . -94.99 26.62 18.0 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -90.06 -16.83 28.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -1.151 . . . . 0.0 109.569 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 23' ' ' ASP . 27.2 mt-10 -105.44 69.35 0.83 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.146 -0.971 . . . . 0.0 109.683 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.446 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . 39.58 28.43 0.12 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' N ' ' O ' ' A' ' 21' ' ' GLU . 11.9 t70 -179.47 137.26 0.13 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.098 -1.236 . . . . 0.0 109.662 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.545 ' CG ' ' HA3' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -108.83 112.94 25.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.304 -0.872 . . . . 0.0 109.383 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.459 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 3.0 t-80 -170.07 -35.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.642 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.54 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -145.06 170.2 16.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.814 HD23 ' C ' ' A' ' 31' ' ' GLU . 1.7 mp -117.79 128.0 54.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.236 -0.915 . . . . 0.0 110.032 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.547 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -74.26 161.39 29.97 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.005 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.547 ' N ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -28.93 0.24 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.873 -1.142 . . . . 0.0 109.488 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 28' ' ' LYS . 3.0 m -82.29 -40.73 21.11 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.376 -0.827 . . . . 0.0 110.164 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.814 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -58.64 -40.35 83.17 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.794 -1.191 . . . . 0.0 108.483 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.866 HD21 ' SG ' ' A' ' 68' ' ' CYS . 17.8 mt -62.94 -61.83 2.13 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.31 -27.22 0.14 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 109.757 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.28 -67.33 0.76 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.661 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.03 HD21 HG11 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -42.02 -30.73 0.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.424 -0.797 . . . . 0.0 110.086 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.052 HD12 HG21 ' A' ' 80' ' ' VAL . 6.0 mm -85.38 -41.86 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.187 -0.945 . . . . 0.0 109.421 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -87.51 11.6 14.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.551 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.482 ' HB3' ' OH ' ' A' ' 17' ' ' TYR . 3.8 m120 -118.09 -44.72 2.68 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.448 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 3' ' ' LEU . 13.8 mm-40 -109.32 -9.89 14.96 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.278 -0.889 . . . . 0.0 109.49 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.662 HD11 HG13 ' A' ' 77' ' ' VAL . 5.6 mp -119.63 41.78 3.05 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 109.471 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.472 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 35.3 p -122.42 12.05 10.06 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.495 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -105.5 -60.34 1.64 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.211 -0.93 . . . . 0.0 109.426 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -89.74 0.07 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.0 109.498 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 81' ' ' THR . 2.0 pp -49.57 -28.7 5.92 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.232 -0.918 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.473 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 13.9 mt-10 43.21 -96.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.348 -0.845 . . . . 0.0 109.47 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.519 ' OE1' ' CG2' ' A' ' 52' ' ' VAL . 0.3 OUTLIER 42.15 -157.86 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.233 -0.917 . . . . 0.0 109.556 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.649 HG23 HG23 ' A' ' 53' ' ' VAL . 8.6 mt 56.29 163.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.227 -0.921 . . . . 0.0 109.394 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.517 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 6.4 ptmt 163.23 -34.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.286 -0.883 . . . . 0.0 109.384 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HG3' ' HG3' ' A' ' 50' ' ' GLN . 25.3 pt-20 -140.43 -38.44 0.44 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.87 . . . . 0.0 109.412 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.5 ' HG3' ' HG3' ' A' ' 49' ' ' GLU . 2.2 pt20 167.72 48.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.202 -0.936 . . . . 0.0 109.612 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.67 -70.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.178 -0.951 . . . . 0.0 109.281 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.956 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.3 t -91.63 -12.96 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.0 108.878 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.678 HG11 ' HD3' ' A' ' 33' ' ' LYS . 35.8 t -82.58 -27.51 8.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.14 -0.975 . . . . 0.0 108.84 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -90.46 -34.37 15.62 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.475 -0.766 . . . . 0.0 109.106 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -81.15 -45.15 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.342 -0.849 . . . . 0.0 109.407 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 1.067 HG22 HD21 ' A' ' 60' ' ' LEU . 1.3 p -64.9 -44.04 96.24 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.064 -1.023 . . . . 0.0 109.303 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -41.01 -47.58 3.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.584 -0.698 . . . . 0.0 109.922 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.06 -44.61 97.12 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.185 -0.947 . . . . 0.0 108.848 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 59' ' ' THR . 17.7 m -73.24 -8.95 58.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.444 -0.785 . . . . 0.0 109.608 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.067 HD21 HG22 ' A' ' 56' ' ' VAL . 2.9 mt -85.66 -74.69 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.145 -0.972 . . . . 0.0 109.388 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.71 93.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.61 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.26 13.32 34.7 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.261 -0.899 . . . . 0.0 109.412 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.02 -45.34 2.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.0 109.541 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.07 91.16 2.15 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.62 -36.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.301 -1.117 . . . . 0.0 108.492 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 39.81 2.12 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.54 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -156.38 113.39 3.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -1.157 . . . . 0.0 109.331 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' A' ' 32' ' ' LEU . 94.9 m -69.8 157.77 36.73 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.215 -0.928 . . . . 0.0 110.076 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -118.42 170.6 8.79 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.323 -0.861 . . . . 0.0 109.093 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.433 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.1 OUTLIER -50.56 -64.76 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.366 -0.834 . . . . 0.0 111.293 -179.216 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 5.4 pt20 -45.28 -27.95 0.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.039 -1.038 . . . . 0.0 108.732 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.615 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . 3.3 mt-10 -77.58 -41.8 37.51 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.501 -0.75 . . . . 0.0 110.009 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CE2' HD23 ' A' ' 10' ' ' LEU . 2.6 t80 -51.51 -50.41 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.81 -1.182 . . . . 0.0 109.016 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.851 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mtp -62.81 -38.7 91.75 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.5 -0.75 . . . . 0.0 109.347 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -69.6 -16.67 63.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.172 -0.955 . . . . 0.0 108.787 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.934 ' CD1' HD22 ' A' ' 60' ' ' LEU . 15.0 m-30 -75.14 -70.05 0.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.711 ' CG2' HD23 ' B' ' 3' ' ' LEU . 99.2 t -52.1 -29.97 12.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.056 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.906 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -62.93 -44.45 96.05 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.679 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.8 OUTLIER -76.3 -69.64 0.49 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 109.968 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 1.052 HG21 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.85 -23.38 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 O-C-N 120.575 -1.328 . . . . 0.0 109.717 -178.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.686 ' HA ' HD22 ' A' ' 44' ' ' LEU . 15.7 m -80.4 -67.81 0.74 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.893 -1.129 . . . . 0.0 108.927 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.1 t -77.32 -49.72 14.37 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.95 . . . . 0.0 108.768 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.87 -30.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.408 0.623 . . . . 0.0 109.557 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.474 ' N ' ' O ' ' A' ' 82' ' ' THR . 42.9 t -89.66 -41.66 11.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.312 -0.868 . . . . 0.0 109.448 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.411 ' N ' ' O ' ' A' ' 82' ' ' THR . 36.1 t60 -63.19 -11.92 24.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.633 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' A' ' 86' ' ' GLU . 6.2 tp10 -82.06 -35.65 28.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.94 . . . . 0.0 109.442 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -26.79 49.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.3 -0.875 . . . . 0.0 109.492 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -69.59 -23.23 63.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.275 -0.891 . . . . 0.0 109.505 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -128.72 91.71 3.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.483 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -86.38 144.88 27.11 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.251 -0.905 . . . . 0.0 109.46 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.468 179.987 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.459 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.808 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 5.2 mm-40 -64.82 -54.87 24.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.276 -0.89 . . . . 0.0 109.301 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.711 HD23 ' CG2' ' A' ' 77' ' ' VAL . 6.0 mp -70.98 -19.72 62.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.308 -0.87 . . . . 0.0 109.402 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.459 ' HB2' ' N ' ' B' ' 1' ' ' SER . 15.2 tp10 -63.05 -56.02 20.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.229 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.494 ' HD3' ' HD2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -64.69 -39.2 93.26 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.261 -0.899 . . . . 0.0 108.758 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -69.73 -16.12 63.27 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.299 -0.876 . . . . 0.0 109.106 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.946 ' CE ' HD13 ' B' ' 11' ' ' ILE . 6.5 tpt -77.23 -50.55 12.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.417 -0.802 . . . . 0.0 109.26 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.45 ' C ' HG22 ' B' ' 11' ' ' ILE . 12.2 p -65.29 -31.03 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.234 -0.916 . . . . 0.0 109.476 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.659 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -79.88 -69.76 0.56 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.932 . . . . 0.0 109.564 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.753 HD11 ' HB1' ' A' ' 6' ' ' ALA . 36.7 mt -43.91 -45.74 7.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 109.59 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.946 HD13 ' CE ' ' B' ' 7' ' ' MET . 0.5 OUTLIER -61.08 -46.66 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.204 -0.935 . . . . 0.0 109.449 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.584 ' N ' HG23 ' B' ' 11' ' ' ILE . 40.5 t0 -65.68 -15.2 62.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.276 -0.89 . . . . 0.0 109.475 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.653 HG21 ' HB2' ' A' ' 2' ' ' GLU . 2.2 t -89.7 -31.45 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 0.0 109.269 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.572 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 8.1 t80 -69.28 -46.13 67.95 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.995 -1.066 . . . . 0.0 109.123 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -78.14 -39.61 40.59 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.4 tt0 -62.92 -63.33 1.24 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 109.457 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.619 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 28.5 m-85 -53.7 -41.12 66.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.259 -0.9 . . . . 0.0 109.541 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB3' ' N ' ' B' ' 25' ' ' HIS . 1.7 m -61.51 -32.68 72.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.215 -0.928 . . . . 0.0 109.665 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.55 31.12 5.97 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.5 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 27.6 mmm180 -90.08 -30.84 17.44 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.15 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.6 mt-10 -153.71 93.99 1.73 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 109.525 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 57.99 158.16 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' C ' ' CG ' ' B' ' 24' ' ' LYS . 10.7 m-20 60.3 155.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.495 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.444 ' CG ' ' C ' ' B' ' 23' ' ' ASP . 0.9 OUTLIER -154.41 63.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.572 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -170.03 -35.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -118.98 167.27 11.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.0 109.588 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' B' ' 31' ' ' GLU . 79.6 mt -118.07 121.2 39.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.803 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.676 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.2 OUTLIER -73.08 168.13 19.7 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.179 -0.951 . . . . 0.0 108.655 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -43.34 -26.95 0.22 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.16 -0.962 . . . . 0.0 109.537 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.423 ' N ' ' O ' ' B' ' 28' ' ' LYS . 31.2 m -74.5 -62.41 1.53 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.288 -0.883 . . . . 0.0 109.975 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.936 ' HB3' HD22 ' B' ' 27' ' ' LEU . 48.2 mm-40 -45.72 -42.47 11.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.092 -1.005 . . . . 0.0 109.223 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 1.053 HD22 ' HE3' ' B' ' 57' ' ' MET . 4.3 mp -55.29 -69.44 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.601 -0.687 . . . . 0.0 109.264 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.999 ' HD3' HG11 ' B' ' 53' ' ' VAL . 4.5 mmtp -38.95 -32.47 0.09 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.465 -0.772 . . . . 0.0 109.744 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' B' ' 38' ' ' ASN . 0.3 OUTLIER -65.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.307 -0.87 . . . . 0.0 109.237 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 3' ' ' LEU . 3.9 mm? -44.43 -26.15 0.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.299 -0.875 . . . . 0.0 109.464 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.913 HG13 HG22 ' B' ' 53' ' ' VAL . 1.1 mm -75.01 -61.97 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.472 ' OD1' ' HA ' ' B' ' 46' ' ' GLU . 24.5 m-80 -87.91 18.75 3.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.706 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 23.4 t-20 -114.54 -44.91 3.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -0.909 . . . . 0.0 109.261 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 18.3 mm-40 -123.46 -9.99 7.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.332 -0.855 . . . . 0.0 109.451 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.858 ' HB3' HD11 ' B' ' 44' ' ' LEU . 18.4 mt -109.06 52.86 0.7 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.442 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.0 m -99.05 3.79 46.91 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.569 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.75 -81.63 0.14 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.923 . . . . 0.0 109.398 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -65.02 -74.32 0.11 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.463 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.858 HD11 ' HB3' ' B' ' 40' ' ' LEU . 0.3 OUTLIER -69.03 97.57 0.88 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.466 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.423 ' O ' ' O ' ' B' ' 44' ' ' LEU . 0.0 OUTLIER -43.89 -90.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.281 -0.887 . . . . 0.0 109.499 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.472 ' HA ' ' OD1' ' B' ' 37' ' ' ASN . 0.7 OUTLIER -126.02 52.63 1.67 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 109.436 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.932 ' CD1' HG21 ' B' ' 53' ' ' VAL . 42.8 mt 61.48 135.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.427 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.53 ' HB2' ' CG ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -86.26 61.37 6.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.224 -0.923 . . . . 0.0 109.393 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' B' ' 50' ' ' GLN . 0.5 OUTLIER 64.13 59.24 1.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.288 -0.883 . . . . 0.0 109.307 -179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 4.8 mt-30 65.33 48.93 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.324 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.53 ' CG ' ' HB2' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -88.8 -70.15 0.66 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.211 -0.931 . . . . 0.0 109.568 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 1.004 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -91.46 -12.88 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.449 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.999 HG11 ' HD3' ' B' ' 33' ' ' LYS . 75.3 t -84.34 -25.28 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.051 -1.031 . . . . 0.0 108.793 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -88.22 -33.93 17.95 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -51.28 8.23 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.429 -0.795 . . . . 0.0 108.956 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.898 ' O ' HD12 ' B' ' 60' ' ' LEU . 1.3 p -59.59 -40.61 82.54 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 O-C-N 121.208 -0.932 . . . . 0.0 108.92 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' MET . . . . . 1.053 ' HE3' HD22 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -42.17 -48.39 4.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.578 -0.701 . . . . 0.0 109.42 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.61 -43.2 99.41 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.291 -0.881 . . . . 0.0 109.071 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.417 ' O ' HG22 ' B' ' 59' ' ' THR . 8.3 m -66.27 -13.69 60.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.31 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 1.013 HD22 ' CD2' ' B' ' 32' ' ' LEU . 2.1 mp -95.29 -28.79 14.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 0.0 109.469 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.417 ' O ' ' C ' ' B' ' 62' ' ' ASN . 0.5 OUTLIER -65.46 114.32 4.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.214 -0.929 . . . . 0.0 109.535 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' B' ' 61' ' ' ASP . 2.5 t30 -44.31 -37.65 3.42 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 0.0 109.363 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 179.29 32.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.0 109.675 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 93.44 1.71 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.52 -35.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.339 -1.095 . . . . 0.0 108.446 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 101.36 38.61 3.23 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.504 ' CB ' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -143.5 104.39 4.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -1.134 . . . . 0.0 109.425 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.521 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.6 t -69.69 156.54 38.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.858 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.5 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -115.46 171.61 7.61 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.483 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -59.03 -50.84 72.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.156 -0.965 . . . . 0.0 110.357 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.491 ' HB3' ' CE ' ' A' ' 79' ' ' MET . 0.9 OUTLIER -56.24 -39.4 72.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.254 -0.904 . . . . 0.0 109.161 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.505 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -79.59 -16.07 56.52 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.463 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.538 ' CZ ' HG12 ' B' ' 13' ' ' VAL . 54.3 t80 -69.46 -56.3 7.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.224 -0.922 . . . . 0.0 108.705 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.906 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 10.7 mtt -63.74 -49.32 73.48 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.44 -26.36 65.13 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.304 -0.872 . . . . 0.0 108.963 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.663 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.1 OUTLIER -64.6 -70.59 0.22 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.408 -0.807 . . . . 0.0 108.862 179.681 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.577 HG21 ' CD2' ' A' ' 3' ' ' LEU . 87.9 t -56.42 -20.61 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.25 -0.906 . . . . 0.0 108.958 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -64.25 -54.38 34.22 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.46 -0.775 . . . . 0.0 109.423 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.633 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.4 OUTLIER -68.24 -61.36 1.88 Allowed 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.345 -0.847 . . . . 0.0 109.652 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 1.004 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -48.43 -22.08 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.361 -1.462 . . . . 0.0 109.376 -179.402 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 3.6 m -79.23 -69.94 0.54 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.039 -1.038 . . . . 0.0 109.185 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.8 t -73.82 -49.17 26.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.063 -1.023 . . . . 0.0 109.227 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.55 -43.84 0.42 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.756 -0.59 . . . . 0.0 109.893 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.53 -50.33 71.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.469 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -10.12 49.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.295 -0.878 . . . . 0.0 109.53 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 82' ' ' THR . 20.9 mt-10 -73.72 -19.02 60.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 109.539 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -50.6 -22.26 1.93 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.216 -0.928 . . . . 0.0 109.512 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -70.37 -47.43 60.97 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.246 -0.908 . . . . 0.0 109.499 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' B' ' 90' ' ' HIS . 11.7 tt0 65.34 25.95 12.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.486 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.426 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 1.4 m-70 69.62 124.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.483 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.28 0.562 . . . . 0.0 109.487 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.705 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -64.05 -70.82 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.225 -0.922 . . . . 0.0 109.525 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.069 HD13 HD23 ' B' ' 10' ' ' LEU . 3.7 mm? -75.37 -32.5 60.85 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.468 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.0 OUTLIER -60.25 -60.29 4.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.272 -0.892 . . . . 0.0 109.559 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -63.07 -30.51 71.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -0.914 . . . . 0.0 109.507 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.725 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -75.4 -18.12 60.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.484 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.454 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 42.4 ttm -80.93 -48.88 11.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.459 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 42.5 t -68.29 -29.62 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 109.508 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -69.9 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.597 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.567 ' CD2' HD23 ' B' ' 3' ' ' LEU . 13.2 mt -46.0 -47.01 16.8 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 0.0 109.559 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.891 HD11 HG21 ' B' ' 81' ' ' THR . 12.3 mt -60.39 -41.16 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.933 . . . . 0.0 109.491 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.499 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 37.6 t0 -63.03 -21.4 66.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.493 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.027 HG21 HD11 ' B' ' 3' ' ' LEU . 2.3 t -84.11 -31.37 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.928 . . . . 0.0 109.391 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 15.1 t80 -68.0 -44.66 76.08 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.017 -1.052 . . . . 0.0 109.21 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -41.13 23.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.296 -0.877 . . . . 0.0 109.501 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.499 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 9.8 tt0 -60.16 -61.63 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.95 . . . . 0.0 109.443 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.656 ' CG ' HD21 ' A' ' 35' ' ' LEU . 32.7 m-85 -57.28 -50.66 72.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' ' HA ' ' A' ' 24' ' ' LYS . 38.1 t -61.24 -18.72 59.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.618 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -64.68 -31.8 82.1 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.428 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -70.3 -43.38 70.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.273 -1.134 . . . . 0.0 109.481 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 28' ' ' LYS . 22.2 tp10 -97.06 135.04 39.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.263 -0.898 . . . . 0.0 109.442 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 52.85 -145.78 19.46 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.458 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 0.4 OUTLIER -80.38 -74.65 0.3 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -1.137 . . . . 0.0 109.491 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.473 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 168.79 46.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 109.424 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.32 -14.72 7.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.0 109.695 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' CG ' ' HB3' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -149.04 170.08 19.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 0.0 109.613 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.904 HD22 ' HB3' ' A' ' 31' ' ' GLU . 96.4 mt -118.01 127.08 53.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.776 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 4.3 tttp -69.81 152.89 44.05 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' N ' ' A' ' 30' ' ' SER . 4.2 ptpt -37.14 -30.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.453 -0.779 . . . . 0.0 109.847 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.51 ' N ' ' HG3' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -74.97 -50.9 15.11 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.247 -0.908 . . . . 0.0 109.38 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.904 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.1 mp0 -49.91 -43.81 49.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 108.905 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.948 HD12 ' SD ' ' A' ' 57' ' ' MET . 31.3 mt -57.15 -66.82 0.39 Allowed 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.673 -0.642 . . . . 0.0 109.275 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.958 ' HG2' HG11 ' A' ' 53' ' ' VAL . 2.5 mttp -41.35 -31.35 0.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -0.835 . . . . 0.0 109.779 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -64.54 -68.61 0.34 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.18 -0.95 . . . . 0.0 109.35 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.656 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.1 mm? -44.04 -44.79 7.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.693 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -53.4 -48.09 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.202 -0.937 . . . . 0.0 109.631 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' C ' ' A' ' 38' ' ' ASN . 9.1 m-20 -73.97 -67.26 0.62 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.111 -0.993 . . . . 0.0 110.055 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.441 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.5 OUTLIER -40.83 -70.49 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.442 -0.786 . . . . 0.0 110.269 -179.436 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 77' ' ' VAL . 31.5 tt0 -67.59 -51.8 46.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.174 -0.954 . . . . 0.0 110.026 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.958 ' HB3' HD13 ' A' ' 44' ' ' LEU . 2.4 mp -98.15 65.85 1.76 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.199 -0.938 . . . . 0.0 109.572 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -95.22 1.54 54.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.321 -0.862 . . . . 0.0 109.606 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -78.96 -68.36 0.66 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.416 ' C ' HD12 ' A' ' 44' ' ' LEU . 66.6 m-85 -100.85 12.34 37.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.435 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.958 HD13 ' HB3' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -146.56 31.69 0.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.475 -179.949 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.484 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 10.4 tp10 -43.79 -75.03 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' A' ' 47' ' ' ILE . 5.7 tm-20 -113.35 30.02 7.53 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.312 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.555 ' CD1' HG21 ' A' ' 53' ' ' VAL . 1.5 mt 55.91 106.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.887 . . . . 0.0 109.255 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -43.03 -27.15 0.18 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.3 -0.875 . . . . 0.0 109.562 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.52 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 1.5 mm-40 164.23 63.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.398 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 2.9 mm-40 51.62 48.82 22.15 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.253 -0.905 . . . . 0.0 109.329 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -87.49 -70.07 0.65 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.588 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -88.16 -22.42 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.226 -0.921 . . . . 0.0 109.601 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.958 HG11 ' HG2' ' A' ' 33' ' ' LYS . 78.8 t -78.9 -29.93 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.068 -1.02 . . . . 0.0 109.262 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 19.5 t0 -77.12 -49.31 15.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.272 -0.892 . . . . 0.0 109.221 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -50.35 51.37 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.662 ' O ' HG22 ' A' ' 59' ' ' THR . 1.9 p -58.43 -49.35 82.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.09 -1.007 . . . . 0.0 109.072 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.948 ' SD ' HD12 ' A' ' 32' ' ' LEU . 8.5 tpt -41.53 -44.31 2.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.79 . . . . 0.0 109.802 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 26.1 mt-10 -57.01 -48.19 79.06 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.23 -0.919 . . . . 0.0 109.424 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.861 HG21 ' CE ' ' A' ' 79' ' ' MET . 4.7 t -76.23 -9.7 58.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.278 -0.889 . . . . 0.0 109.977 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.651 HD11 ' CD1' ' A' ' 76' ' ' PHE . 16.7 mt -87.27 3.05 48.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.491 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 61' ' ' ASP . 17.8 p-10 -85.46 114.59 22.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.17 -0.956 . . . . 0.0 109.47 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -52.45 -22.0 4.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.506 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 176.99 40.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.91 . . . . 0.0 109.472 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.419 ' O ' ' CG ' ' A' ' 65' ' ' ASP . . . 77.63 90.36 0.32 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 176.28 -32.46 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.277 -1.131 . . . . 0.0 108.579 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.12 -22.36 23.16 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mm-40 -70.01 106.94 3.4 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -1.115 . . . . 0.0 109.389 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 14.2 t -69.92 157.08 38.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 109.679 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.506 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 34.3 t0 -117.58 171.26 8.13 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -58.74 -50.3 74.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.479 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 2.3 mp0 -56.81 -40.22 75.57 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.819 . . . . 0.0 108.983 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 mt-10 -76.63 -17.15 59.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.428 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.476 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 26.4 t80 -71.54 -49.56 39.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.19 -0.944 . . . . 0.0 108.966 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.936 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mmt -66.04 -54.31 27.45 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.312 -0.867 . . . . 0.0 109.034 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.63 -26.3 66.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.24 -0.913 . . . . 0.0 108.999 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CD1' HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.25 -68.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 39' ' ' GLU . 53.4 t -62.75 -20.53 25.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.835 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -69.19 -30.86 69.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.447 -0.783 . . . . 0.0 109.269 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.861 ' CE ' HG21 ' A' ' 59' ' ' THR . 20.7 mtp -85.47 -67.53 0.8 Allowed 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.838 0.827 . . . . 0.0 109.072 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.946 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.15 -22.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 O-C-N 120.4 -1.438 . . . . 0.0 109.505 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.57 ' CA ' HD21 ' A' ' 40' ' ' LEU . 45.2 m -85.15 -61.1 1.85 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.007 -1.058 . . . . 0.0 108.468 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.554 HG21 ' CB ' ' B' ' 70' ' ' PHE . 1.4 m -80.28 -55.27 5.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.32 -42.12 0.19 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.276 0.56 . . . . 0.0 109.933 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 87' ' ' PHE . 30.4 t -69.03 -58.88 3.51 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.912 . . . . 0.0 109.463 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.421 ' C ' ' O ' ' A' ' 84' ' ' CYS . 2.1 t60 -44.5 -64.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -49.12 -36.02 17.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.45 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -57.97 -47.76 81.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.309 -0.869 . . . . 0.0 109.474 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.491 ' O ' ' CB ' ' A' ' 89' ' ' GLU . 8.9 m-85 -60.95 -35.95 78.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.205 -0.934 . . . . 0.0 109.442 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.491 ' CB ' ' O ' ' A' ' 88' ' ' PHE . 1.6 tt0 74.31 -164.86 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.269 -0.895 . . . . 0.0 109.484 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.25 54.35 0.97 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.274 -0.891 . . . . 0.0 109.459 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.487 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.489 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 58.4 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.73 -74.9 0.08 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.291 -0.881 . . . . 0.0 109.488 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 1.027 HD11 HG21 ' A' ' 13' ' ' VAL . 3.3 mp -71.16 -28.08 64.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.941 . . . . 0.0 109.488 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.489 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 34.4 tt0 -58.13 -58.3 9.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.394 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -59.49 -50.97 71.85 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.88 . . . . 0.0 109.336 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.655 ' O ' HD12 ' B' ' 10' ' ' LEU . . . -61.88 -14.78 37.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.447 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.473 ' HG3' ' OE2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -76.39 -53.64 7.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.425 ' H ' HG23 ' B' ' 8' ' ' VAL . 2.7 t -62.62 -27.69 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.705 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -80.17 -69.86 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 1.069 HD23 HD13 ' A' ' 3' ' ' LEU . 12.1 mt -44.4 -53.17 7.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 109.487 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.752 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 22.1 mm -55.61 -58.22 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 109.886 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -51.4 -19.92 1.56 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.034 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 1.002 HG13 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -88.58 -36.28 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.034 -1.041 . . . . 0.0 109.595 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.553 ' CD1' ' HB2' ' B' ' 73' ' ' PHE . 27.3 t80 -58.86 -41.64 87.49 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.777 -1.202 . . . . 0.0 108.837 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' B' ' 16' ' ' GLN . 0.3 OUTLIER -80.7 -46.25 15.84 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.334 -0.853 . . . . 0.0 109.252 179.727 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' B' ' 15' ' ' HIS . 1.7 tt0 -44.72 -40.17 5.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 108.685 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.521 ' O ' ' N ' ' B' ' 19' ' ' GLY . 3.9 m-85 -91.36 -79.23 0.37 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.546 ' HA ' HD23 ' B' ' 27' ' ' LEU . 32.2 t 37.0 29.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.242 0.544 . . . . 0.0 110.042 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' B' ' 31' ' ' GLU . . . 74.79 51.78 7.66 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -63.49 -10.01 15.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.328 -1.101 . . . . 0.0 109.814 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -93.18 69.91 4.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.998 . . . . 0.0 109.382 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.92 -42.16 1.49 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.459 ' O ' ' O ' ' B' ' 19' ' ' GLY . 1.1 m-20 -141.36 -153.3 0.45 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -1.174 . . . . 0.0 109.455 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.431 ' C ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -176.75 43.13 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.541 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.47 ' N ' ' OG ' ' B' ' 18' ' ' SER . 0.7 OUTLIER -122.44 -16.61 7.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.264 -0.897 . . . . 0.0 109.688 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.07 170.21 7.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.263 -0.898 . . . . 0.0 109.349 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' B' ' 18' ' ' SER . 12.6 mt -84.94 137.96 32.79 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 2.0 ptmt -109.67 73.12 0.83 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.225 -0.922 . . . . 0.0 109.504 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.4 tttm 61.54 -85.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.4 -0.813 . . . . 0.0 110.037 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 1.7 t -45.63 -39.43 7.75 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.134 -0.978 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.532 ' HB3' HD22 ' B' ' 27' ' ' LEU . 3.2 mm-40 -47.96 -50.12 28.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.94 -1.1 . . . . 0.0 108.745 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.756 HD21 ' CE2' ' B' ' 76' ' ' PHE . 1.1 mt -59.14 -55.76 30.89 Favored 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.712 ' HD3' HG11 ' B' ' 53' ' ' VAL . 7.7 mttp -42.56 -33.82 0.76 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.436 -0.79 . . . . 0.0 109.595 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -71.7 -66.14 0.67 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.683 -179.768 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 1.002 HD21 HG13 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -41.98 -60.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.363 -0.835 . . . . 0.0 110.231 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.832 HG22 HD22 ' B' ' 44' ' ' LEU . 80.7 mt -57.4 -53.55 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.326 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.772 HD22 HD11 ' B' ' 47' ' ' ILE . 1.2 m-20 -83.39 15.99 2.75 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.132 -0.98 . . . . 0.0 110.36 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.527 ' N ' ' O ' ' B' ' 34' ' ' GLU . 22.6 t30 -135.7 4.28 3.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.531 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 4.7 mp0 -133.19 -37.31 0.98 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.101 -0.999 . . . . 0.0 109.49 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.977 HD22 ' CD1' ' B' ' 44' ' ' LEU . 5.4 mp -75.7 -54.71 6.53 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.15 -0.969 . . . . 0.0 109.407 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.441 ' HA ' ' HG2' ' B' ' 45' ' ' GLU . 0.7 OUTLIER 47.45 24.62 0.5 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.293 -0.88 . . . . 0.0 109.223 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.17 -86.75 0.57 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.299 -0.876 . . . . 0.0 109.524 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -93.68 7.7 43.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.977 ' CD1' HD22 ' B' ' 40' ' ' LEU . 0.5 OUTLIER -109.29 -79.0 0.59 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.212 -0.93 . . . . 0.0 109.502 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' B' ' 46' ' ' GLU . 1.1 mm-40 44.32 90.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 109.335 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 2.2 mm-40 63.71 16.7 9.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 0.0 109.305 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.772 HD11 HD22 ' B' ' 37' ' ' ASN . 1.6 mt 56.54 109.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.887 . . . . 0.0 109.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.6 ptpt -43.35 -32.48 0.83 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.522 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' B' ' 49' ' ' GLU . 4.0 pt-20 179.01 54.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.258 -0.901 . . . . 0.0 109.498 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.597 ' HA ' HG21 ' B' ' 47' ' ' ILE . 1.8 mt-30 48.45 53.8 11.46 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' B' ' 55' ' ' LYS . 0.5 OUTLIER -90.21 -70.09 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.285 -0.884 . . . . 0.0 109.798 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 1.025 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -86.49 -20.2 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 109.75 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.712 HG11 ' HD3' ' B' ' 33' ' ' LYS . 25.4 t -80.71 -36.92 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.056 -1.027 . . . . 0.0 108.892 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.538 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 36.6 t70 -81.6 -28.84 33.55 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.009 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 0.9 OUTLIER -77.66 -43.32 31.7 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.339 -0.85 . . . . 0.0 109.238 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.788 HG13 ' O ' ' B' ' 52' ' ' VAL . 15.8 m -57.04 -51.76 64.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 121.181 -0.949 . . . . 0.0 109.656 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.559 ' N ' HG23 ' B' ' 56' ' ' VAL . 1.7 tpt -40.19 -28.42 0.06 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.116 -0.99 . . . . 0.0 109.752 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' B' ' 56' ' ' VAL . 3.7 mt-10 -77.91 -48.4 16.45 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.065 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.48 ' O ' ' C ' ' B' ' 60' ' ' LEU . 38.8 m -74.55 -63.16 1.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.292 -0.88 . . . . 0.0 109.354 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 1.077 HD22 ' CD1' ' B' ' 76' ' ' PHE . 10.5 mt -34.95 -36.81 0.06 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.298 0.57 . . . . 0.0 110.128 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' B' ' 59' ' ' THR . 10.3 t70 -81.89 73.58 8.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 -87.57 -27.04 22.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.88 . . . . 0.0 109.489 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -82.25 -51.5 7.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.902 . . . . 0.0 109.488 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.97 90.72 2.13 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -175.49 -35.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -1.146 . . . . 0.0 108.595 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.62 38.46 2.22 Favored Glycine 0 N--CA 1.485 1.964 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NZ ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -153.63 108.06 3.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.315 -1.109 . . . . 0.0 109.493 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.545 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 75.1 m -69.64 156.06 39.54 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.342 -0.849 . . . . 0.0 109.898 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.455 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 8.5 m-20 -117.43 170.29 8.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.358 -0.839 . . . . 0.0 108.944 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.752 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -48.83 -67.43 0.27 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 111.319 -179.385 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.522 ' NE2' ' HG2' ' B' ' 72' ' ' GLU . 1.5 pp0? -44.21 -27.81 0.45 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.21 -0.931 . . . . 0.0 108.955 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.612 ' O ' ' CD1' ' B' ' 76' ' ' PHE . 4.6 mt-10 -77.38 -43.2 33.6 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.407 -0.808 . . . . 0.0 109.809 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.879 ' HE1' HD22 ' B' ' 35' ' ' LEU . 12.6 t80 -49.15 -49.18 43.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.925 -1.11 . . . . 0.0 108.988 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.835 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 6.4 mtt -64.0 -41.31 97.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.437 -0.789 . . . . 0.0 109.381 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -66.42 -16.3 63.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.269 -0.894 . . . . 0.0 108.747 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 1.077 ' CD1' HD22 ' B' ' 60' ' ' LEU . 13.3 m-30 -75.5 -70.25 0.44 Allowed 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD12 ' A' ' 3' ' ' LEU . 39.4 t -52.64 -24.89 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.936 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -64.4 -48.04 76.91 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.37 -0.831 . . . . 0.0 109.36 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.681 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 67.0 mtp -74.74 -67.54 0.63 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -0.888 . . . . 0.0 109.841 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 1.025 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.99 -23.44 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 120.435 -1.416 . . . . 0.0 109.704 -178.924 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.891 HG21 HD11 ' A' ' 11' ' ' ILE . 7.8 m -80.28 -68.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.906 -1.121 . . . . 0.0 108.795 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.5 t -77.65 -49.33 14.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.179 -0.951 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.46 -37.1 0.18 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.261 0.553 . . . . 0.0 109.791 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 3.1 t -90.05 -35.34 15.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 0.0 109.505 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.484 ' O ' ' HG2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -65.79 -9.99 33.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' B' ' 89' ' ' GLU . 59.8 mt-10 -70.68 -21.06 62.63 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -76.97 -29.78 55.69 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.249 -0.907 . . . . 0.0 109.504 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -86.89 -30.65 21.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 109.484 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 85' ' ' HIS . 6.9 pt-20 -130.75 -169.1 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.0 109.495 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.472 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 27.5 t-80 74.0 121.51 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.513 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.482 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.838 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -70.22 -51.94 27.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.296 -0.878 . . . . 0.0 109.306 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.012 HD22 ' OE1' ' B' ' 39' ' ' GLU . 2.0 mp -72.41 -29.45 63.74 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.513 ' CD ' ' CZ ' ' B' ' 43' ' ' PHE . 1.2 tt0 -58.74 -64.5 0.91 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.197 -0.939 . . . . 0.0 109.312 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -43.57 98.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.208 -0.932 . . . . 0.0 109.265 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -68.41 -9.99 52.19 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.448 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.471 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -83.64 -52.71 6.22 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.917 . . . . 0.0 109.403 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.01 -20.36 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.862 . . . . 0.0 109.444 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.515 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -83.59 -60.21 2.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.213 -0.93 . . . . 0.0 109.639 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.869 HD22 HD23 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -54.7 -38.46 67.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.591 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.741 HD11 HG21 ' B' ' 81' ' ' THR . 36.6 mt -68.17 -57.71 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.566 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -56.49 -19.05 13.52 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.277 -0.889 . . . . 0.0 109.46 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.896 HG11 HD21 ' B' ' 3' ' ' LEU . 0.8 OUTLIER -88.38 -29.9 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.138 -0.977 . . . . 0.0 109.253 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 73' ' ' PHE . 6.0 t80 -66.2 -41.4 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.051 -1.03 . . . . 0.0 109.075 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.658 ' CE1' ' CD2' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -78.46 -43.42 27.21 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.884 . . . . 0.0 109.388 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.63 -55.65 20.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -0.925 . . . . 0.0 109.447 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.518 ' HE1' HG22 ' A' ' 13' ' ' VAL . 20.9 m-85 -60.4 -43.75 96.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 109.532 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 5.5 p -56.92 -22.12 35.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.47 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.467 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -71.23 -35.93 63.78 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 19' ' ' GLY . 42.0 mmm-85 -43.96 -47.14 8.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -1.108 . . . . 0.0 109.464 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' A' ' 22' ' ' GLY . 3.4 tm-20 -70.42 154.67 41.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.461 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.23 -26.41 0.92 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.67 -149.8 0.18 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -174.26 65.6 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.275 -0.891 . . . . 0.0 109.425 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.658 ' CD2' ' CE1' ' A' ' 15' ' ' HIS . 7.3 m80 -169.28 -35.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.576 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' N ' ' HB2' ' A' ' 18' ' ' SER . 22.6 mtmt -129.34 159.6 35.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -0.906 . . . . 0.0 109.492 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.963 HD23 ' C ' ' A' ' 31' ' ' GLU . 7.3 mp -95.2 167.11 11.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 109.454 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -134.39 79.95 1.83 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.552 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.721 ' H ' HD13 ' A' ' 32' ' ' LEU . 4.1 ttmt 61.81 -85.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 110.3 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.428 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 6.8 m -44.68 -49.65 10.3 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 0.0 110.435 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.963 ' C ' HD23 ' A' ' 27' ' ' LEU . 63.9 mm-40 -63.11 -34.46 77.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.029 -1.045 . . . . 0.0 109.716 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.113 HD23 HD13 ' A' ' 60' ' ' LEU . 1.9 mp -61.37 -70.19 0.2 Allowed 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.434 -0.791 . . . . 0.0 109.674 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 9.1 ttmt -42.43 -39.28 2.16 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.332 -0.855 . . . . 0.0 109.75 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -58.7 -56.64 19.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.8 HD21 HG13 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -46.85 -35.27 6.16 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 109.476 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.803 HG22 HD13 ' A' ' 44' ' ' LEU . 1.2 mp -72.31 -39.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.592 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 57.0 m-80 -78.66 -1.75 35.86 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.185 -0.947 . . . . 0.0 109.809 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.513 ' ND2' ' OH ' ' A' ' 17' ' ' TYR . 21.0 t-20 -107.45 -25.02 11.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.593 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.629 ' OE1' HD22 ' A' ' 40' ' ' LEU . 3.1 tm-20 -99.42 -44.97 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -0.929 . . . . 0.0 109.505 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.972 HD11 ' HA ' ' A' ' 81' ' ' THR . 3.6 mm? -56.11 -44.92 79.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.217 -0.927 . . . . 0.0 109.407 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.518 ' C ' ' CG ' ' A' ' 42' ' ' HIS . 0.4 OUTLIER 76.04 60.03 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.545 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.518 ' CG ' ' C ' ' A' ' 41' ' ' SER . 5.4 m-70 76.57 -1.43 2.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.263 -0.898 . . . . 0.0 109.657 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.771 ' HB3' HD12 ' A' ' 40' ' ' LEU . 1.7 t80 -60.11 -27.1 66.75 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.156 -0.965 . . . . 0.0 109.356 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.843 HD11 ' CB ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -113.49 -15.21 12.62 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.277 -0.889 . . . . 0.0 109.324 179.891 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 63.94 61.86 0.92 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.267 -0.896 . . . . 0.0 109.409 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.426 ' O ' ' C ' ' A' ' 47' ' ' ILE . 33.0 tt0 46.38 83.41 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.91 . . . . 0.0 109.385 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.761 HD13 HG21 ' A' ' 53' ' ' VAL . 3.9 mp -43.71 143.69 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.293 -0.879 . . . . 0.0 109.469 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 pttt -149.57 -48.7 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.474 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.489 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 87.9 mt-10 -64.81 -10.84 31.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.365 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 0.8 OUTLIER 75.29 54.28 0.07 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.292 -0.88 . . . . 0.0 109.448 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.83 -70.4 0.68 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.251 -0.906 . . . . 0.0 109.606 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.914 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.2 t -92.03 -24.78 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.112 -0.993 . . . . 0.0 109.251 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.761 HG21 HD13 ' A' ' 47' ' ' ILE . 39.2 t -78.58 -18.57 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.0 109.36 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.6 t0 -87.69 -37.67 16.5 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.239 -0.913 . . . . 0.0 109.44 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -78.81 -39.21 36.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.782 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.0 m -65.08 -46.16 92.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -43.51 -25.74 0.17 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.117 -0.989 . . . . 0.0 110.144 -179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.8 OUTLIER -86.39 -47.15 9.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.074 -1.016 . . . . 0.0 109.892 -179.632 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . 1.01 HG21 ' HE3' ' A' ' 79' ' ' MET . 7.2 t -68.98 -9.76 53.92 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.226 -0.921 . . . . 0.0 109.828 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.113 HD13 HD23 ' A' ' 32' ' ' LEU . 6.7 mt -94.4 -68.57 0.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.504 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 57' ' ' MET . 49.7 p-10 -65.03 87.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.495 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -82.94 -9.34 59.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.15 -22.43 16.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.235 -0.916 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 79.9 69.14 1.42 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 26.6 t70 178.36 32.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.287 -1.125 . . . . 0.0 108.374 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.43 64.89 3.08 Favored Glycine 0 N--CA 1.482 1.721 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 6.0 mt-10 -143.9 84.81 1.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.317 -1.108 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 69' ' ' ASP . 16.0 t -69.95 157.08 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 109.724 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.84 171.85 7.78 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.753 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.33 -51.35 70.3 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.248 -0.907 . . . . 0.0 110.412 -179.601 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 72' ' ' GLU . 17.6 pt20 -57.27 -40.32 77.46 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.229 -0.92 . . . . 0.0 108.802 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mt-10 -77.36 -16.17 59.02 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.467 -0.77 . . . . 0.0 109.349 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 14' ' ' PHE . 56.9 t80 -70.38 -64.19 0.94 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.929 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 2.7 tpp -58.11 -43.38 87.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.2 -28.03 69.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.439 -0.788 . . . . 0.0 109.126 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.62 ' CZ ' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -62.34 -69.8 0.24 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 108.797 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.3 t -57.07 -22.78 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.975 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -57.69 -52.76 64.1 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.508 -0.745 . . . . 0.0 109.418 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . 1.01 ' HE3' HG21 ' A' ' 59' ' ' THR . 0.7 OUTLIER -73.94 -63.26 1.25 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.436 -0.79 . . . . 0.0 109.923 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.914 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -47.88 -22.14 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 O-C-N 120.314 -1.492 . . . . 0.0 109.378 -179.14 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.972 ' HA ' HD11 ' A' ' 40' ' ' LEU . 4.5 m -79.1 -67.77 0.72 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.01 -1.056 . . . . 0.0 108.863 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.57 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -79.43 -49.43 12.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.135 -0.978 . . . . 0.0 108.837 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.85 -34.88 0.12 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.678 -0.639 . . . . 0.0 109.694 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 30.7 t -82.31 -46.13 14.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.493 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -47.03 -25.11 0.75 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.232 -0.918 . . . . 0.0 109.49 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.55 -50.7 13.26 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 0.0 109.508 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.74 -18.96 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.183 -0.948 . . . . 0.0 109.54 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -46.34 -63.28 1.04 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.496 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 4.1 pt-20 -56.35 168.64 0.52 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 109.471 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.451 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 39.8 m-70 60.82 177.62 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.879 . . . . 0.0 109.506 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.495 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.515 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -64.37 -78.66 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.894 . . . . 0.0 109.769 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.896 HD21 HG11 ' A' ' 13' ' ' VAL . 90.0 mt -63.01 -25.24 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.126 -0.983 . . . . 0.0 109.892 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.52 ' O ' ' CG ' ' B' ' 7' ' ' MET . 1.0 OUTLIER -69.8 -70.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.127 -0.983 . . . . 0.0 109.537 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -60.28 -17.7 44.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 109.466 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.704 ' HB1' HD23 ' A' ' 10' ' ' LEU . . . -85.79 -26.81 25.57 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -0.921 . . . . 0.0 109.765 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.546 ' O ' HD12 ' B' ' 11' ' ' ILE . 3.4 ptt? -78.87 -31.74 45.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.128 -0.983 . . . . 0.0 109.474 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.521 ' N ' ' HG3' ' B' ' 7' ' ' MET . 56.0 t -82.39 -39.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.202 -0.936 . . . . 0.0 109.386 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.838 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -66.85 -42.95 84.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.24 -0.913 . . . . 0.0 109.41 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.584 HD13 ' HB1' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -68.65 -62.56 1.33 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.671 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 85.7 mt -44.98 -41.75 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.181 -0.95 . . . . 0.0 109.209 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.515 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 23.0 t0 -58.83 -61.81 2.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.311 -0.868 . . . . 0.0 109.364 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.54 -25.45 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.337 -0.852 . . . . 0.0 109.434 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 4.3 t80 -72.32 -49.69 32.54 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.927 -1.108 . . . . 0.0 109.344 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -75.91 -9.99 59.06 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 110.013 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.515 ' CG ' ' O ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -90.2 -61.69 1.63 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.047 -1.033 . . . . 0.0 109.319 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.586 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 34.2 m-85 -57.98 -43.77 86.71 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.573 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.701 ' N ' HD21 ' B' ' 27' ' ' LEU . 2.7 p -74.64 -14.01 60.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.508 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.545 ' CA ' ' HG2' ' B' ' 24' ' ' LYS . . . -92.54 8.98 76.65 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.502 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 54.7 mtp85 -87.81 -59.88 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -1.15 . . . . 0.0 109.396 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.2 OUTLIER -80.33 170.11 16.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.298 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' B' ' 23' ' ' ASP . . . -52.01 89.46 0.01 OUTLIER Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' B' ' 22' ' ' GLY . 0.5 OUTLIER 162.39 -164.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -1.084 . . . . 0.0 109.365 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.545 ' HG2' ' CA ' ' B' ' 19' ' ' GLY . 0.0 OUTLIER 171.05 58.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.236 -0.915 . . . . 0.0 109.458 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 16.5 t60 -170.27 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.302 -0.874 . . . . 0.0 109.643 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.551 ' CE ' ' HB3' ' B' ' 67' ' ' GLU . 1.4 ptmt -127.03 166.03 18.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.202 -0.936 . . . . 0.0 109.574 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.701 HD21 ' N ' ' B' ' 18' ' ' SER . 20.7 mt -121.16 130.62 53.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.265 -0.897 . . . . 0.0 109.859 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' B' ' 29' ' ' LYS . 5.0 ttpt -69.6 155.54 40.33 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -39.98 -38.68 0.74 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.185 -0.947 . . . . 0.0 109.732 -179.464 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.33 -46.15 71.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.324 -0.86 . . . . 0.0 109.582 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.525 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -53.03 -44.62 67.5 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.021 -1.049 . . . . 0.0 108.352 179.62 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.702 ' CD1' HD22 ' B' ' 60' ' ' LEU . 3.6 mm? -51.78 -70.71 0.08 Allowed 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.615 ' HE3' HG21 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -37.28 -33.11 0.05 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.731 -0.606 . . . . 0.0 110.146 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.448 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -69.84 -61.03 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.137 -0.977 . . . . 0.0 109.635 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -53.04 -20.6 3.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.332 -0.855 . . . . 0.0 110.052 -179.627 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 1.055 HD12 HG22 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -82.42 -49.06 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.047 -1.033 . . . . 0.0 109.391 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -75.77 0.05 19.31 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.182 -0.949 . . . . 0.0 109.462 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.455 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 0.6 OUTLIER -118.73 -22.33 7.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.163 -0.96 . . . . 0.0 109.576 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 1.012 ' OE1' HD22 ' A' ' 3' ' ' LEU . 18.5 pt-20 -91.59 -45.07 8.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 1.0 HD22 ' CG ' ' B' ' 39' ' ' GLU . 0.8 OUTLIER -84.19 -50.6 7.75 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 108.616 179.348 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.472 ' O ' ' CB ' ' B' ' 42' ' ' HIS . 0.0 OUTLIER 52.1 65.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.591 -0.693 . . . . 0.0 109.657 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.472 ' CB ' ' O ' ' B' ' 41' ' ' SER . 0.0 OUTLIER 74.43 -0.01 3.46 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.304 -0.872 . . . . 0.0 109.647 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 40' ' ' LEU . 1.2 m-85 -57.91 -36.1 71.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.047 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.858 HD21 ' HG ' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -124.02 -22.07 4.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.357 -0.84 . . . . 0.0 109.64 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' B' ' 44' ' ' LEU . 13.0 pt-20 39.68 65.44 0.71 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.393 -0.817 . . . . 0.0 109.76 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.808 ' OE2' HG12 ' B' ' 80' ' ' VAL . 0.2 OUTLIER -129.14 -18.5 3.68 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.309 -179.453 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 1.006 HD13 HG23 ' B' ' 53' ' ' VAL . 12.0 mt -81.81 72.67 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.973 -1.079 . . . . 0.0 110.048 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.2 pttt -44.85 -27.38 0.51 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.215 -0.928 . . . . 0.0 108.819 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' B' ' 48' ' ' LYS . 10.5 pt-20 178.08 -32.23 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.494 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -165.05 28.02 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.388 -0.82 . . . . 0.0 109.251 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -69.16 -70.77 0.25 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.43 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 1.018 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -91.03 -9.89 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.11 -0.994 . . . . 0.0 109.009 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.055 HG22 HD12 ' B' ' 36' ' ' ILE . 10.6 t -84.85 -29.67 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.494 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 17.9 t0 -90.15 -28.88 18.64 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -84.93 -49.81 8.03 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.442 -0.786 . . . . 0.0 109.105 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.77 ' O ' HD12 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -63.06 -41.52 93.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.132 -0.98 . . . . 0.0 108.754 179.578 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.496 ' HB2' ' O ' ' B' ' 53' ' ' VAL . 0.9 OUTLIER -43.06 -46.09 5.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.481 -0.762 . . . . 0.0 109.238 179.605 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -60.66 -48.25 82.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.227 -0.92 . . . . 0.0 109.009 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.4 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 4.0 m -64.36 -13.95 53.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.352 -0.843 . . . . 0.0 109.196 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.788 HD21 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mp -92.25 -81.41 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.336 -0.853 . . . . 0.0 109.494 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.461 ' HA ' ' O ' ' B' ' 67' ' ' GLU . 46.1 p-10 -59.17 89.17 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' B' ' 60' ' ' LEU . 0.2 OUTLIER -103.01 -1.66 28.9 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.621 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.434 ' HB2' ' OE2' ' B' ' 67' ' ' GLU . 0.7 OUTLIER -81.54 -9.34 59.71 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.118 -0.989 . . . . 0.0 109.488 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.39 81.85 0.43 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.72 -32.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.242 -1.152 . . . . 0.0 108.635 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.08 37.34 1.84 Allowed Glycine 0 N--CA 1.486 1.981 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.551 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -129.61 149.25 51.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.258 -1.142 . . . . 0.0 109.467 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 10.2 t -95.58 155.61 16.67 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.699 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' B' ' 72' ' ' GLU . 17.2 t70 -121.39 171.18 8.95 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.671 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -60.26 -54.29 47.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.135 -0.978 . . . . 0.0 110.334 -179.554 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.779 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.7 pt20 -56.55 -21.72 28.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.086 -1.009 . . . . 0.0 108.815 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' B' ' 76' ' ' PHE . 14.9 mm-40 -84.61 -30.46 24.94 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.559 -0.713 . . . . 0.0 109.159 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.736 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 37.1 t80 -62.85 -47.03 85.14 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.407 -0.808 . . . . 0.0 109.083 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.975 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 3.1 mtt -70.33 -56.63 6.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.348 -0.845 . . . . 0.0 109.301 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.43 -16.08 21.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 108.928 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.788 ' HB2' HD21 ' B' ' 60' ' ' LEU . 2.5 t80 -72.49 -68.99 0.43 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.512 -0.742 . . . . 0.0 109.137 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.634 HG21 HD23 ' A' ' 3' ' ' LEU . 42.7 t -56.1 -27.92 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.259 -0.901 . . . . 0.0 109.162 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.929 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.16 -36.46 81.85 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.378 -0.826 . . . . 0.0 109.5 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.624 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.0 OUTLIER -77.08 -68.16 0.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 109.557 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 1.018 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.41 -24.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 O-C-N 120.606 -1.309 . . . . 0.0 109.068 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.741 HG21 HD11 ' A' ' 11' ' ' ILE . 8.8 m -76.77 -69.19 0.53 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.142 -0.974 . . . . 0.0 109.395 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.4 t -75.34 -49.55 18.76 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.04 -1.037 . . . . 0.0 108.922 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.38 -30.33 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.761 -0.587 . . . . 0.0 109.775 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' B' ' 82' ' ' THR . 15.7 t -81.4 -46.65 14.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.304 -0.872 . . . . 0.0 109.604 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.574 ' O ' ' CD1' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -67.36 -9.85 45.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' ' O ' ' B' ' 89' ' ' GLU . 4.1 mm-40 -83.99 -15.78 46.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 109.598 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -30.84 71.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.892 . . . . 0.0 109.605 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' B' ' 85' ' ' HIS . 0.6 OUTLIER -47.78 -26.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.234 -0.917 . . . . 0.0 109.557 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' B' ' 90' ' ' HIS . 3.3 tp10 -157.34 150.59 23.74 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 109.422 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.451 ' N ' ' HG3' ' B' ' 89' ' ' GLU . 58.9 t-80 -116.16 169.18 9.47 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.428 ' OXT' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 117.965 -1.017 . . . . 0.0 109.486 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.277 0.56 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.763 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 2.9 mm-40 -68.76 -48.94 62.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.241 -0.912 . . . . 0.0 109.272 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.915 HD11 HD21 ' B' ' 35' ' ' LEU . 5.5 mt -78.99 -23.3 44.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.31 -0.869 . . . . 0.0 109.423 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.71 -61.99 2.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.127 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.44 -41.72 96.4 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.292 -0.88 . . . . 0.0 109.183 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.526 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -70.94 -10.77 60.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.385 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.614 ' CE ' HD13 ' B' ' 40' ' ' LEU . 2.7 mtp -82.07 -54.84 4.97 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.197 -0.939 . . . . 0.0 109.289 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.503 ' HA ' HD12 ' A' ' 11' ' ' ILE . 31.5 t -62.21 -32.76 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.328 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.91 ' HB1' ' HG2' ' B' ' 2' ' ' GLU . . . -73.17 -65.9 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.272 -0.892 . . . . 0.0 109.527 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.707 ' CD2' HD23 ' B' ' 3' ' ' LEU . 4.7 mt -44.47 -34.53 2.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.207 -0.933 . . . . 0.0 109.335 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.503 HD12 ' HA ' ' A' ' 8' ' ' VAL . 54.6 mt -63.39 -52.24 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.921 . . . . 0.0 109.361 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.53 -19.81 40.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.229 -0.919 . . . . 0.0 109.222 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.91 HG11 HD21 ' B' ' 3' ' ' LEU . 1.3 t -83.4 -29.78 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.338 -0.851 . . . . 0.0 109.333 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 46.7 t80 -70.5 -42.71 70.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.918 -1.114 . . . . 0.0 109.138 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.33 -34.12 36.93 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.31 -0.869 . . . . 0.0 109.492 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.21 -62.13 1.58 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.206 -0.934 . . . . 0.0 109.445 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.575 ' CD2' ' HG ' ' A' ' 35' ' ' LEU . 28.2 m-85 -56.6 -47.22 80.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.304 -0.873 . . . . 0.0 109.413 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 4.6 p -70.0 -17.56 63.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.478 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -91.26 15.31 61.47 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.1 mmt85 -89.61 -43.19 10.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.25 -1.147 . . . . 0.0 109.483 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 20' ' ' ARG . 7.0 mt-10 -164.9 119.73 1.35 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.252 -0.905 . . . . 0.0 109.47 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.545 ' HA3' ' HZ1' ' A' ' 26' ' ' LYS . . . 143.12 -117.3 1.09 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 22.4 m-20 -115.48 -2.99 12.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -1.161 . . . . 0.0 109.671 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 0.6 OUTLIER 76.25 17.7 2.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 109.502 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -142.04 10.82 1.97 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 109.482 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.545 ' HZ1' ' HA3' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -170.14 167.36 8.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.196 -0.94 . . . . 0.0 109.499 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.94 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.3 mp -100.31 164.78 11.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -0.932 . . . . 0.0 109.442 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 1.7 ptmm? -128.4 74.85 1.58 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.25 -0.906 . . . . 0.0 109.479 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 32' ' ' LEU . 11.4 ttmt 61.83 -85.57 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.395 -0.816 . . . . 0.0 110.206 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.47 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -44.8 -48.41 10.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.94 ' C ' HD23 ' A' ' 27' ' ' LEU . 78.5 mm-40 -56.02 -40.55 73.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 109.302 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.831 HD22 HD23 ' A' ' 60' ' ' LEU . 38.8 mt -60.06 -69.97 0.19 Allowed 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.633 -0.667 . . . . 0.0 109.571 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.471 ' HG2' ' OD1' ' A' ' 37' ' ' ASN . 14.2 ttmt -42.54 -27.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.318 -0.864 . . . . 0.0 109.729 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' N ' ' OE1' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -66.54 -54.32 25.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 109.469 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.879 HD21 HG13 ' A' ' 13' ' ' VAL . 16.1 mt -53.49 -37.49 62.78 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.676 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.084 HD11 ' CE2' ' A' ' 76' ' ' PHE . 3.1 mm -69.0 -38.7 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.553 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' OD1' ' HG2' ' A' ' 33' ' ' LYS . 7.2 m120 -82.88 -6.63 59.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 109.661 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.422 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -99.69 -18.24 17.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.514 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.703 ' OE1' HG13 ' A' ' 77' ' ' VAL . 19.6 tt0 -111.04 -57.57 2.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.229 -0.919 . . . . 0.0 109.544 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.674 ' H ' HD12 ' A' ' 40' ' ' LEU . 6.3 mp -65.5 -53.69 38.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.267 -0.896 . . . . 0.0 109.52 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER 162.84 -86.82 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.336 -0.853 . . . . 0.0 109.329 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 1.9 m-70 -141.31 -41.85 0.38 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.278 -0.889 . . . . 0.0 109.368 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.519 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -158.45 21.7 0.23 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.993 HD21 HD12 ' A' ' 47' ' ' ILE . 0.1 OUTLIER 36.04 -93.58 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.698 -0.626 . . . . 0.0 110.167 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -95.32 -83.16 0.36 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.168 -0.957 . . . . 0.0 109.653 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -132.71 41.42 3.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.206 -0.934 . . . . 0.0 109.408 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.993 HD12 HD21 ' A' ' 44' ' ' LEU . 1.6 mt -58.26 -50.88 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.42 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER -40.78 -25.81 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.434 -0.791 . . . . 0.0 109.678 -179.754 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -95.64 41.7 1.1 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.211 179.773 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 10.0 mt-30 45.9 48.12 12.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.899 . . . . 0.0 109.515 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -90.14 -70.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.288 -0.883 . . . . 0.0 109.536 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.926 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.7 t -92.37 -15.58 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.199 -0.938 . . . . 0.0 109.168 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.676 HG23 HG23 ' A' ' 47' ' ' ILE . 42.5 t -81.71 -23.57 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 108.896 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 1.1 t0 -86.19 -30.26 22.56 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.32 -0.862 . . . . 0.0 109.085 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -82.65 -46.15 13.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 0.0 109.217 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.784 HG22 ' O ' ' A' ' 52' ' ' VAL . 35.3 m -58.37 -43.79 87.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.181 -0.949 . . . . 0.0 109.544 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.563 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.2 -28.47 3.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.086 -1.009 . . . . 0.0 109.99 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 59' ' ' THR . 1.2 pp20? -82.58 -34.64 27.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.043 -1.036 . . . . 0.0 109.719 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.524 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 16.9 m -78.31 -64.84 1.07 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.177 -0.952 . . . . 0.0 109.267 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.092 HD21 ' CG ' ' A' ' 76' ' ' PHE . 8.8 mp -39.41 -31.6 0.09 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.608 -0.682 . . . . 0.0 109.791 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' THR . 0.4 OUTLIER -43.96 105.84 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 61' ' ' ASP . 18.9 t-20 -44.93 -48.53 11.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -178.61 31.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.245 -0.91 . . . . 0.0 109.575 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.02 90.78 1.54 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -175.82 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.286 -1.126 . . . . 0.0 108.509 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.24 27.21 6.62 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.534 ' HB2' ' CG ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -138.13 119.07 14.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.256 -1.143 . . . . 0.0 109.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.0 t -69.89 158.61 35.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.215 -0.928 . . . . 0.0 109.782 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.543 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.75 172.12 7.58 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 1.5 t80 -60.16 -56.2 24.51 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.885 . . . . 0.0 110.585 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.842 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -57.27 -31.18 65.34 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.886 . . . . 0.0 109.275 -179.431 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.543 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 0.1 OUTLIER -79.18 -23.9 43.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.392 -0.817 . . . . 0.0 108.986 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.817 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.9 t80 -65.34 -58.04 6.9 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.416 -0.802 . . . . 0.0 108.952 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.24 -41.57 93.44 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.26 -0.9 . . . . 0.0 109.028 179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.44 -26.07 68.56 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.081 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 1.092 ' CG ' HD21 ' A' ' 60' ' ' LEU . 2.1 t80 -67.79 -63.59 1.03 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.352 -0.843 . . . . 0.0 109.31 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.703 HG13 ' OE1' ' A' ' 39' ' ' GLU . 25.3 t -58.9 -25.42 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.315 -0.866 . . . . 0.0 108.963 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.856 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.27 -33.4 74.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.43 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.6 OUTLIER -81.7 -68.11 0.72 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.926 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -49.08 -21.01 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 O-C-N 120.546 -1.346 . . . . 0.0 110.114 -178.936 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.578 HG23 ' N ' ' A' ' 82' ' ' THR . 5.8 t -87.61 -49.73 6.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.675 -1.265 . . . . 0.0 108.901 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.584 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.1 m -90.57 -56.39 3.22 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -33.73 -34.16 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.313 0.578 . . . . 0.0 109.913 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' N ' ' O ' ' A' ' 82' ' ' THR . 41.0 t -79.03 -50.17 11.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.227 -0.921 . . . . 0.0 109.529 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.0 OUTLIER -53.78 -56.74 14.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.263 -0.898 . . . . 0.0 109.512 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.438 ' O ' ' OXT' ' A' ' 91' ' ' GLU . 2.4 pt-20 -60.94 -19.76 61.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.562 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -81.63 -26.61 34.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -77.49 -70.04 0.5 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.237 -0.914 . . . . 0.0 109.482 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 2.7 pt-20 -111.8 168.02 9.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.243 -0.91 . . . . 0.0 109.5 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.443 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER 71.44 43.22 0.63 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.52 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.438 ' OXT' ' O ' ' A' ' 86' ' ' GLU . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.431 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.91 ' HG2' ' HB1' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -63.86 -72.2 0.15 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.587 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.91 HD21 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -62.33 -23.13 66.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.335 -0.853 . . . . 0.0 109.696 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.404 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 4.0 tt0 -62.56 -62.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.443 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -26.82 68.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.208 -0.933 . . . . 0.0 109.27 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -74.93 -23.6 58.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 109.429 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -37.75 36.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.266 -0.896 . . . . 0.0 109.466 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.46 ' O ' HG22 ' B' ' 11' ' ' ILE . 74.8 t -71.07 -35.61 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.26 -0.9 . . . . 0.0 109.642 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -78.21 -56.66 4.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.184 -0.948 . . . . 0.0 109.564 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.771 HD23 HD22 ' A' ' 3' ' ' LEU . 3.5 mt -54.29 -47.03 72.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 109.595 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.828 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -58.22 -46.89 88.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.137 -0.977 . . . . 0.0 109.425 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.571 ' N ' HG23 ' B' ' 11' ' ' ILE . 2.6 m-20 -58.91 -22.74 60.24 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.138 -0.976 . . . . 0.0 109.492 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.845 HG11 HD11 ' A' ' 3' ' ' LEU . 1.1 t -85.56 -29.98 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.504 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 49.3 t80 -66.5 -42.24 87.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.798 -1.189 . . . . 0.0 109.246 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -76.83 -41.32 44.7 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -0.917 . . . . 0.0 109.534 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.62 -65.91 0.62 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 0.0 109.516 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.587 ' CD1' HG13 ' B' ' 13' ' ' VAL . 33.0 m-85 -50.75 -41.7 56.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 109.379 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.53 ' HB3' ' N ' ' B' ' 26' ' ' LYS . 1.4 m -88.32 43.05 1.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.276 -0.89 . . . . 0.0 109.468 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.14 -61.05 0.67 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -50.96 -20.62 1.41 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.377 -1.072 . . . . 0.0 110.005 -179.604 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' B' ' 28' ' ' LYS . 4.5 tm-20 -69.68 155.14 40.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.087 -1.008 . . . . 0.0 109.421 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . -43.2 -91.79 0.01 OUTLIER Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.306 -1.518 . . . . 0.0 109.306 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.531 ' O ' ' N ' ' B' ' 25' ' ' HIS . 1.5 m-20 -68.31 86.99 0.29 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.223 -1.163 . . . . 0.0 108.948 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 18' ' ' SER . 8.6 pttp -41.97 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.451 -0.781 . . . . 0.0 109.829 -179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 23' ' ' ASP . 1.0 OUTLIER -170.46 -35.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.244 -0.91 . . . . 0.0 109.706 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -128.25 164.63 22.15 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.766 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.7 HD22 HD23 ' B' ' 32' ' ' LEU . 7.5 mp -90.56 164.55 14.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.34 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -131.32 74.35 1.59 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.325 -0.86 . . . . 0.0 109.346 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER 63.54 -83.21 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.607 -0.683 . . . . 0.0 110.363 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.465 ' O ' ' OE1' ' B' ' 34' ' ' GLU . 1.4 t -45.02 -44.55 10.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.147 -0.97 . . . . 0.0 110.591 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.678 ' C ' HD23 ' B' ' 27' ' ' LEU . 19.9 mm-40 -61.87 -39.32 91.5 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.76 -1.213 . . . . 0.0 108.718 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.7 HD23 HD22 ' B' ' 27' ' ' LEU . 28.9 mt -55.35 -70.31 0.11 Allowed 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 1.03 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -44.45 -28.12 0.53 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.885 . . . . 0.0 109.731 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -67.72 -68.36 0.39 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.126 -0.984 . . . . 0.0 109.558 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.915 HD21 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -41.72 -49.32 4.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.389 -0.819 . . . . 0.0 109.862 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.614 HD12 HG21 ' B' ' 80' ' ' VAL . 6.4 mm -56.0 -58.79 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.155 -0.965 . . . . 0.0 109.567 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.523 ' OD1' ' CG1' ' B' ' 47' ' ' ILE . 0.7 OUTLIER -85.06 15.19 4.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.0 109.844 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' B' ' 34' ' ' GLU . 5.2 m-20 -116.63 -8.97 11.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.473 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.527 ' HG2' ' CG ' ' A' ' 3' ' ' LEU . 12.5 mp0 -133.78 -44.38 0.81 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 1.007 HD12 HD21 ' B' ' 44' ' ' LEU . 3.8 mm? -56.49 -62.7 1.55 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.212 -0.93 . . . . 0.0 109.202 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER 80.58 -70.57 0.08 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.699 . . . . 0.0 110.62 179.25 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.86 -1.81 1.38 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.8 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.677 ' HB3' HD23 ' B' ' 44' ' ' LEU . 5.3 t80 -61.82 -13.97 28.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.801 -1.187 . . . . 0.0 108.835 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 1.007 HD21 HD12 ' B' ' 40' ' ' LEU . 0.1 OUTLIER -136.81 12.26 3.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.384 -0.823 . . . . 0.0 109.165 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 46' ' ' GLU . 4.1 mt-10 64.15 38.29 8.38 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.219 -0.925 . . . . 0.0 109.375 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 45' ' ' GLU . 1.8 mt-10 51.53 176.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 109.376 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.809 HG13 HG21 ' B' ' 53' ' ' VAL . 1.5 mm -85.56 87.39 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.39 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.485 ' CE ' ' OE2' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -43.38 -48.2 6.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.478 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -158.51 58.09 0.45 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.231 -0.918 . . . . 0.0 109.278 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.543 ' N ' HG22 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 62.35 36.23 14.58 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.257 -0.902 . . . . 0.0 109.294 -179.856 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' B' ' 48' ' ' LYS . 3.1 tt0 -65.18 -70.14 0.25 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.338 -0.851 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.924 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.5 t -88.57 -15.67 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.221 -0.925 . . . . 0.0 109.414 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.03 HG11 ' HG3' ' B' ' 33' ' ' LYS . 52.3 t -78.93 -30.38 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.087 -1.008 . . . . 0.0 108.927 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 21.0 t0 -82.82 -36.86 25.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.291 -0.881 . . . . 0.0 109.069 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -72.01 -47.43 51.98 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 0.0 109.208 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.861 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 33.9 m -59.84 -45.73 94.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 O-C-N 121.252 -0.905 . . . . 0.0 109.391 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.592 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.22 -24.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.878 -1.139 . . . . 0.0 109.977 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.8 tt0 -88.29 -45.86 9.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.11 -0.993 . . . . 0.0 110.377 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.758 HG21 ' SD ' ' B' ' 79' ' ' MET . 8.5 t -69.82 -52.91 21.0 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.913 -1.117 . . . . 0.0 110.003 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.751 HD21 ' CG ' ' B' ' 76' ' ' PHE . 5.6 mt -44.81 -65.27 0.55 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.986 -1.071 . . . . 0.0 109.093 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -45.55 102.61 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 109.496 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.54 11.06 7.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' HB2' ' B' ' 65' ' ' ASP . 3.4 p30 -111.39 -13.69 13.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 109.438 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.89 77.34 1.0 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.431 ' HB2' ' OD1' ' B' ' 63' ' ' ASP . 0.4 OUTLIER 178.14 -33.24 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.222 -1.163 . . . . 0.0 108.632 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.19 4.66 29.04 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.491 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 2.3 mm-40 -98.15 137.81 36.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -1.177 . . . . 0.0 109.446 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.5 t -79.33 159.21 27.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.169 -0.957 . . . . 0.0 109.639 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.503 ' CB ' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -125.69 171.51 10.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.378 -0.826 . . . . 0.0 108.82 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.8 OUTLIER -58.03 -53.31 59.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.224 -0.923 . . . . 0.0 110.27 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.642 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 26.4 mt-30 -58.16 -30.36 66.32 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.358 -0.839 . . . . 0.0 109.025 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.503 ' HG3' ' CB ' ' B' ' 69' ' ' ASP . 6.2 mt-10 -80.44 -22.02 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.433 -0.792 . . . . 0.0 109.278 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.478 ' HB2' ' CD1' ' B' ' 14' ' ' PHE . 2.8 t80 -69.26 -61.77 1.65 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.286 -0.884 . . . . 0.0 108.795 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.856 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -57.9 -42.51 84.85 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -61.85 -28.79 69.74 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.861 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.7 OUTLIER -64.31 -69.64 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.442 -0.786 . . . . 0.0 108.985 179.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' B' ' 81' ' ' THR . 43.1 t -51.93 -26.55 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.307 -0.87 . . . . 0.0 108.804 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -65.93 -42.97 89.4 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.37 -0.831 . . . . 0.0 109.432 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.758 ' SD ' HG21 ' B' ' 59' ' ' THR . 26.2 mtm -77.89 -69.56 0.54 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.266 -0.896 . . . . 0.0 109.568 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.924 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.69 -24.15 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 O-C-N 120.683 -1.261 . . . . 0.0 110.026 -178.795 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 23.0 m -82.52 -65.69 0.98 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.854 -1.154 . . . . 0.0 108.594 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.1 m -75.59 -54.58 6.77 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -34.89 -46.74 0.32 Allowed 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.213 0.53 . . . . 0.0 110.186 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.462 ' SG ' ' HA ' ' B' ' 44' ' ' LEU . 54.0 t -64.71 -49.74 69.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.213 -0.929 . . . . 0.0 109.585 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -16.88 35.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.892 . . . . 0.0 109.548 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -90.1 -27.02 19.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.926 . . . . 0.0 109.504 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -80.94 -31.95 34.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.546 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -45.68 -57.27 4.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 109.469 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.8 97.82 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.257 -0.902 . . . . 0.0 109.49 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -92.38 125.04 36.87 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.508 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.491 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.773 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -69.71 -60.87 2.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.307 -0.871 . . . . 0.0 109.438 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.989 HD23 HG21 ' B' ' 77' ' ' VAL . 5.9 mp -66.32 -21.67 66.26 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.293 -0.88 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 25.9 mm-40 -63.99 -67.08 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.288 -0.882 . . . . 0.0 109.26 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.529 ' O ' HG12 ' A' ' 8' ' ' VAL . 10.1 mmtt -59.53 -44.89 93.07 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.212 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.656 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -62.86 -20.94 65.6 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.31 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.476 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 59.5 ttp -72.9 -53.03 12.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.314 -0.866 . . . . 0.0 109.334 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.529 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -64.15 -20.86 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.202 -0.937 . . . . 0.0 109.41 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.696 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -80.84 -69.99 0.56 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 109.748 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.515 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.3 OUTLIER -50.64 -48.54 58.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.65 -179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 1.2 mp -58.58 -50.23 79.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.158 -0.964 . . . . 0.0 109.101 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 45.0 t0 -60.53 -19.15 56.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.108 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.923 HG11 HD11 ' B' ' 3' ' ' LEU . 2.2 t -86.98 -26.17 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.078 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -70.45 -46.15 64.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.025 -1.047 . . . . 0.0 109.109 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -77.68 -34.22 53.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.393 -0.817 . . . . 0.0 109.625 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -69.22 -64.48 0.86 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.0 109.383 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.785 ' CG ' HD21 ' A' ' 35' ' ' LEU . 12.0 m-85 -51.25 -53.0 39.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 23' ' ' ASP . 1.4 t -63.7 -25.12 68.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.275 -0.891 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -54.92 -20.26 18.62 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -90.13 -29.44 18.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.256 -1.143 . . . . 0.0 109.658 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -83.35 69.94 10.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -0.931 . . . . 0.0 109.654 -179.838 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 47.02 96.7 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.4 OUTLIER 73.14 -149.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -1.177 . . . . 0.0 109.395 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.22 96.83 2.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.253 -0.905 . . . . 0.0 109.515 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.496 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 34.3 m-70 -145.63 -46.79 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 109.642 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 mttt -137.03 170.21 16.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 109.621 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 1.059 HD13 HD11 ' A' ' 35' ' ' LEU . 85.1 mt -115.5 131.33 56.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.191 -0.943 . . . . 0.0 109.558 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.813 ' O ' HD12 ' A' ' 32' ' ' LEU . 2.8 ptmt -76.78 164.03 26.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.206 -0.934 . . . . 0.0 108.768 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -27.18 0.14 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.92 . . . . 0.0 109.828 -179.742 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.464 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 3.5 m -77.45 -52.58 8.86 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 110.216 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.82 ' HB3' HD22 ' A' ' 27' ' ' LEU . 19.1 mm-40 -55.03 -39.1 68.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.307 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.061 HD13 ' CE ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -62.56 -70.17 0.22 Allowed 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.544 -0.723 . . . . 0.0 109.431 179.794 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.809 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -43.03 -26.61 0.15 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.165 -0.96 . . . . 0.0 109.586 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.492 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -71.4 -51.58 23.25 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.116 -0.99 . . . . 0.0 109.455 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.059 HD11 HD13 ' A' ' 27' ' ' LEU . 2.3 mt -60.15 -51.19 70.64 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.311 -0.868 . . . . 0.0 109.856 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.988 ' CD1' HG21 ' A' ' 80' ' ' VAL . 89.8 mt -62.08 -34.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 109.588 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.813 HD22 HG12 ' A' ' 47' ' ' ILE . 5.0 m120 -92.46 -0.95 57.3 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.679 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 34' ' ' GLU . 0.8 OUTLIER -93.83 -43.44 8.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.54 ' CG ' ' HB2' ' B' ' 3' ' ' LEU . 54.5 mp0 -122.7 -10.06 8.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.31 -0.869 . . . . 0.0 109.4 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' CB ' HD13 ' A' ' 44' ' ' LEU . 2.0 mp -108.6 -6.82 15.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.466 ' HB3' ' HA ' ' A' ' 37' ' ' ASN . 1.9 p -64.55 -10.73 27.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -0.938 . . . . 0.0 109.478 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -98.1 -65.0 0.99 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.402 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.15 -47.26 68.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.252 -0.905 . . . . 0.0 109.314 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.063 ' CD2' HG12 ' A' ' 80' ' ' VAL . 7.7 mp -72.63 -91.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.295 -0.878 . . . . 0.0 109.345 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 1.4 mt-10 162.92 50.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.863 . . . . 0.0 109.378 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER 46.11 42.7 10.09 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.202 -0.937 . . . . 0.0 109.322 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.813 HG12 HD22 ' A' ' 37' ' ' ASN . 0.6 OUTLIER 47.3 93.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.261 -0.9 . . . . 0.0 109.195 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.484 ' HE2' ' HB2' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -43.51 -26.88 0.24 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 109.534 -179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 47' ' ' ILE . 1.3 tp10 176.79 55.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.535 ' HA ' HG21 ' A' ' 47' ' ' ILE . 13.1 mt-30 57.96 35.46 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.274 -0.891 . . . . 0.0 109.295 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -71.65 -70.15 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.239 -0.913 . . . . 0.0 109.756 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 1.012 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.3 t -83.42 -11.06 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.067 -1.02 . . . . 0.0 109.68 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.809 HG11 ' HD3' ' A' ' 33' ' ' LYS . 43.0 t -84.23 -37.43 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.828 -1.17 . . . . 0.0 108.32 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.2 t0 -90.2 -22.1 21.84 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 5.0 mttm -87.49 -48.42 7.96 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.488 -0.757 . . . . 0.0 109.207 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.869 HG22 HD21 ' A' ' 60' ' ' LEU . 1.2 p -64.19 -42.63 96.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 O-C-N 121.179 -0.951 . . . . 0.0 109.094 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . 1.061 ' CE ' HD13 ' A' ' 32' ' ' LEU . 10.7 tpp -43.48 -45.49 6.45 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 5.4 tt0 -61.22 -44.17 97.7 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.236 -0.915 . . . . 0.0 108.827 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.0 m -62.55 -18.92 63.05 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.372 -0.83 . . . . 0.0 109.411 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.869 HD21 HG22 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -91.5 28.82 1.61 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.196 -0.94 . . . . 0.0 108.898 179.571 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 6.6 t0 -85.99 98.48 10.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.489 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.9 -23.33 14.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -140.22 9.71 2.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.261 -0.899 . . . . 0.0 109.47 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.425 ' HA2' ' OD1' ' A' ' 61' ' ' ASP . . . 69.03 83.62 0.16 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 178.8 -33.55 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.22 -1.164 . . . . 0.0 108.576 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 14.52 13.32 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 3.3 pt-20 -87.28 114.93 24.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.3 -1.118 . . . . 0.0 109.469 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.599 ' HB2' HD21 ' A' ' 32' ' ' LEU . 18.8 t -69.74 157.79 36.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -120.69 172.15 8.08 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.526 ' CZ ' HG13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.73 -55.96 16.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.085 -1.009 . . . . 0.0 110.129 -179.81 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.497 ' HG3' ' N ' ' A' ' 72' ' ' GLU . 8.4 pt20 -62.14 -39.4 92.46 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 tt0 -78.68 -10.43 59.75 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.574 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 34.2 t80 -73.73 -51.44 16.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.562 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -64.69 -46.99 80.02 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.03 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -68.32 -20.75 64.77 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.319 -0.863 . . . . 0.0 109.012 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.705 ' CE1' HD11 ' A' ' 36' ' ' ILE . 4.6 t80 -66.68 -70.39 0.25 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.192 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' B' ' 3' ' ' LEU . 81.5 t -60.18 -30.38 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.236 -0.915 . . . . 0.0 108.934 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.651 ' HB2' ' CG ' ' B' ' 74' ' ' MET . . . -60.29 -41.99 94.53 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.415 -0.803 . . . . 0.0 109.196 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.657 ' HE2' HG23 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -63.33 -50.74 68.81 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.163 -0.961 . . . . 0.0 108.701 179.503 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 1.063 HG12 ' CD2' ' A' ' 44' ' ' LEU . 1.5 t -65.33 -9.53 7.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.696 0 O-C-N 121.085 -1.009 . . . . 0.0 109.583 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.939 HG21 ' SD ' ' B' ' 7' ' ' MET . 52.7 m -86.85 -57.76 2.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.223 -0.923 . . . . 0.0 109.382 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -81.91 -48.81 11.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.162 -0.961 . . . . 0.0 109.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.584 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.42 -42.65 1.12 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.704 -0.622 . . . . 0.0 109.871 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.16 -51.3 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.903 . . . . 0.0 109.519 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -74.2 -9.98 59.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 109.497 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.515 ' O ' ' CG ' ' A' ' 89' ' ' GLU . 3.2 mt-10 -75.07 -34.86 61.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' A' ' 86' ' ' GLU . 4.3 t80 -43.8 -29.02 0.48 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 109.593 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.421 ' O ' ' C ' ' A' ' 89' ' ' GLU . 82.4 t80 -90.11 -35.38 15.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.246 -0.909 . . . . 0.0 109.577 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.515 ' CG ' ' O ' ' A' ' 86' ' ' GLU . 0.7 OUTLIER -43.9 155.83 0.07 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.248 -0.908 . . . . 0.0 109.548 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -142.92 -161.69 1.3 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.217 -0.927 . . . . 0.0 109.492 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.504 179.945 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.534 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.696 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 3.6 mm-40 -76.13 -35.85 59.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 109.3 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.923 HD11 HG11 ' A' ' 13' ' ' VAL . 7.5 mp -78.99 -28.1 43.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.285 -0.885 . . . . 0.0 109.442 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.534 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 4.9 tm-20 -68.84 -58.84 3.6 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.899 . . . . 0.0 109.192 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.595 ' O ' HG12 ' B' ' 8' ' ' VAL . 19.4 mttt -62.61 -37.2 85.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.223 -0.923 . . . . 0.0 109.161 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.602 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -66.9 -19.52 65.74 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.38 -0.825 . . . . 0.0 109.308 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.939 ' SD ' HG21 ' A' ' 81' ' ' THR . 10.4 tpt -81.84 -38.47 25.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.342 -0.849 . . . . 0.0 109.368 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.595 HG12 ' O ' ' B' ' 5' ' ' LYS . 2.6 p -68.27 -30.89 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.286 -0.884 . . . . 0.0 109.413 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.773 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -82.47 -52.46 6.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 109.395 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.661 HD12 ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -53.29 -40.87 65.07 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.813 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -68.86 -46.37 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.376 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.58 ' N ' HG23 ' B' ' 11' ' ' ILE . 0.3 OUTLIER -51.89 -26.83 11.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 109.239 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 1.014 HG13 ' CD1' ' B' ' 17' ' ' TYR . 18.9 t -86.81 -30.87 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.26 -0.9 . . . . 0.0 109.366 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 2.7 t80 -59.48 -56.92 15.92 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.834 -1.166 . . . . 0.0 109.027 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.726 ' CD2' ' HB2' ' B' ' 24' ' ' LYS . 5.5 t-80 -72.79 -48.41 38.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 109.636 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 44.9 tt0 -50.5 -68.39 0.18 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.841 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 1.014 ' CD1' HG13 ' B' ' 13' ' ' VAL . 25.4 m-85 -52.97 -32.77 47.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 110.072 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 86.3 p -87.36 31.57 0.73 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.044 -1.035 . . . . 0.0 109.942 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.02 -0.34 48.21 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.87 -58.27 2.63 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -1.17 . . . . 0.0 109.49 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.49 168.58 18.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.229 -0.92 . . . . 0.0 109.477 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.17 -105.88 3.17 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' B' ' 24' ' ' LYS . 0.2 OUTLIER -148.97 -68.67 0.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -1.143 . . . . 0.0 109.476 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.726 ' HB2' ' CD2' ' B' ' 15' ' ' HIS . 2.8 pttt 168.8 39.32 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.91 . . . . 0.0 109.503 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.574 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 3.9 p80 -169.74 27.53 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.713 ' O ' HD23 ' B' ' 27' ' ' LEU . 4.5 ptpt -153.97 167.66 29.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' B' ' 31' ' ' GLU . 78.9 mt -138.34 119.2 14.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.226 -0.921 . . . . 0.0 109.874 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.0 OUTLIER -85.77 118.86 25.53 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.279 -0.888 . . . . 0.0 108.666 179.114 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.535 ' N ' ' CE ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER 20.1 -78.76 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' B' ' 28' ' ' LYS . 69.3 p -40.73 -58.42 1.65 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.979 -1.075 . . . . 0.0 110.794 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.799 ' HB3' HD22 ' B' ' 27' ' ' LEU . 31.1 mm-40 -45.93 -43.84 14.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.903 -1.123 . . . . 0.0 109.166 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' B' ' 27' ' ' LEU . 20.2 mt -53.26 -66.07 0.45 Allowed 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.56 -0.713 . . . . 0.0 109.12 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.619 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -43.62 -36.27 2.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 109.646 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -54.97 -63.08 1.27 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 109.416 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.733 HD11 ' CG1' ' B' ' 13' ' ' VAL . 1.1 mp -50.71 -36.66 37.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.58 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.962 HD13 HG22 ' B' ' 53' ' ' VAL . 4.1 mt -61.43 -39.27 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.706 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.765 HD21 HD11 ' B' ' 47' ' ' ILE . 0.7 OUTLIER -96.38 -70.08 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 109.679 -179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -45.72 -24.34 0.35 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.289 -0.882 . . . . 0.0 109.963 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.883 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -113.91 -40.8 3.67 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.077 -1.015 . . . . 0.0 109.941 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.988 HD23 ' CD1' ' B' ' 44' ' ' LEU . 0.1 OUTLIER -109.52 67.98 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.132 -0.98 . . . . 0.0 109.601 -179.821 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 58.5 p -120.65 43.71 2.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.455 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.498 ' CG ' ' N ' ' B' ' 43' ' ' PHE . 45.3 p-80 -129.65 -47.12 1.16 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.512 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.498 ' N ' ' CG ' ' B' ' 42' ' ' HIS . 0.2 OUTLIER -110.67 9.18 22.88 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.988 ' CD1' HD23 ' B' ' 40' ' ' LEU . 6.5 mp -106.51 -21.62 13.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.256 -0.902 . . . . 0.0 109.489 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.426 ' C ' ' O ' ' B' ' 44' ' ' LEU . 12.9 mt-10 43.8 68.6 0.5 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 63.89 155.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.895 . . . . 0.0 109.465 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.765 HD11 HD21 ' B' ' 37' ' ' ASN . 31.1 mm -64.96 -24.4 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.456 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.2 OUTLIER 84.4 -52.15 0.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.712 -0.618 . . . . 0.0 109.592 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.522 ' N ' ' CG ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -174.21 34.96 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.5 ' HA ' HG21 ' B' ' 47' ' ' ILE . 5.8 mt-30 73.73 38.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -65.47 -70.26 0.25 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.178 -0.951 . . . . 0.0 109.394 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.879 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.4 t -87.56 -15.41 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.142 -0.974 . . . . 0.0 109.152 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.962 HG22 HD13 ' B' ' 36' ' ' ILE . 39.5 t -75.17 -29.83 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.204 -0.935 . . . . 0.0 108.746 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 6.1 t0 -90.13 -36.92 14.56 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.425 -0.797 . . . . 0.0 109.314 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.471 ' HA ' ' OE2' ' B' ' 58' ' ' GLU . 23.7 mtpp -70.63 -36.17 73.32 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.316 -0.865 . . . . 0.0 109.534 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.964 ' HB ' HD13 ' B' ' 60' ' ' LEU . 5.3 m -55.44 -56.13 13.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.642 ' H ' HG23 ' B' ' 56' ' ' VAL . 0.2 OUTLIER -41.11 -28.32 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.93 -1.106 . . . . 0.0 109.625 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.471 ' OE2' ' HA ' ' B' ' 55' ' ' LYS . 45.0 mt-10 -70.06 -55.6 9.09 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' B' ' 60' ' ' LEU . 2.8 m -82.81 -63.06 1.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 1.053 HD21 ' CG ' ' B' ' 76' ' ' PHE . 1.7 mp -37.2 -36.5 0.14 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.761 -0.587 . . . . 0.0 109.898 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.524 ' CB ' ' O ' ' B' ' 57' ' ' MET . 11.1 t0 -90.11 70.03 7.29 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.398 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -100.09 8.88 43.61 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.9 -10.74 17.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.468 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 63.85 78.39 0.19 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 58.8 t0 178.99 -33.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.25 -1.147 . . . . 0.0 108.602 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 -9.37 31.52 Favored Glycine 0 N--CA 1.486 1.973 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.432 ' HB2' ' HD3' ' B' ' 26' ' ' LYS . 12.2 pt-20 -95.56 123.74 39.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -1.148 . . . . 0.0 109.474 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -69.63 133.42 47.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.273 -0.892 . . . . 0.0 109.338 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 23.0 t70 -98.05 170.76 8.7 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -55.74 -47.7 76.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.042 . . . . 0.0 110.061 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.444 ' HG2' ' SD ' ' A' ' 79' ' ' MET . 65.6 mt-30 -50.56 -49.31 56.41 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.546 -0.721 . . . . 0.0 109.319 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.546 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -72.17 -20.83 61.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.541 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.661 ' CE2' HD12 ' B' ' 10' ' ' LEU . 71.8 t80 -59.86 -57.78 11.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.651 ' CG ' ' HB2' ' A' ' 78' ' ' ALA . 3.4 mtt -66.61 -44.14 82.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.332 -0.855 . . . . 0.0 109.605 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -68.61 -12.21 61.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.081 -1.012 . . . . 0.0 109.21 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 1.053 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -81.52 -70.52 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.337 -0.852 . . . . 0.0 109.282 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.989 HG21 HD23 ' A' ' 3' ' ' LEU . 98.5 t -60.59 -30.25 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.88 . . . . 0.0 108.858 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.562 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -66.16 -45.57 80.49 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.459 -0.776 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.643 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 4.3 mmm -63.17 -70.34 0.22 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.059 -1.026 . . . . 0.0 108.914 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.879 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -41.81 -26.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 120.891 -1.131 . . . . 0.0 109.553 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.535 ' HA ' HD21 ' B' ' 40' ' ' LEU . 15.2 m -71.05 -70.23 0.32 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.053 -1.03 . . . . 0.0 108.885 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.0 OUTLIER -79.23 -50.77 10.41 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.113 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.4 -37.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.262 0.553 . . . . 0.0 109.848 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 8.6 t -84.88 -39.53 18.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 109.557 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.486 ' NE2' ' CE2' ' B' ' 43' ' ' PHE . 0.8 OUTLIER -65.38 -9.98 29.49 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.605 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.492 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 0.5 OUTLIER -87.78 -21.55 25.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.241 -0.912 . . . . 0.0 109.525 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.464 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.9 t80 -43.69 -32.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.286 -0.884 . . . . 0.0 109.519 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.08 -43.48 24.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 109.454 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' B' ' 89' ' ' GLU . 4.0 pm0 -95.06 117.91 30.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.944 . . . . 0.0 109.435 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.45 53.81 0.76 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.259 -0.901 . . . . 0.0 109.469 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.449 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.475 ' N ' ' HB2' ' A' ' 4' ' ' GLU . 1.1 t . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.753 ' HB2' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -47.65 -49.2 28.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.0 109.534 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.867 HD11 HG21 ' B' ' 13' ' ' VAL . 2.3 mp -76.49 -23.38 53.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.475 ' HB2' ' N ' ' A' ' 1' ' ' SER . 2.0 mt-10 -62.42 -63.91 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.346 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -38.59 90.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.311 -0.868 . . . . 0.0 109.297 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -70.63 -15.55 62.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.298 -0.876 . . . . 0.0 109.428 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.06 -46.49 16.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.316 -0.865 . . . . 0.0 109.385 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.11 -41.93 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.457 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HB1' ' OE1' ' B' ' 2' ' ' GLU . . . -67.7 -54.18 21.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.922 . . . . 0.0 109.42 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.532 ' HG ' ' CD1' ' B' ' 3' ' ' LEU . 0.2 OUTLIER -47.68 -46.37 29.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.2 -0.937 . . . . 0.0 109.397 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 45.5 mt -59.3 -38.95 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.396 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 91.3 m-20 -64.63 -24.46 67.59 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.262 -0.899 . . . . 0.0 109.532 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.918 HG21 HD21 ' B' ' 3' ' ' LEU . 2.7 t -81.01 -29.87 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 10.9 t80 -69.63 -47.77 62.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.941 -1.099 . . . . 0.0 109.507 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -78.99 -33.43 45.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.558 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 39.1 tt0 -68.82 -64.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.907 . . . . 0.0 109.468 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.69 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 26.0 m-85 -55.4 -48.23 74.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.5 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 33.7 t -69.64 -19.03 63.62 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.289 -0.882 . . . . 0.0 109.47 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.38 16.09 59.77 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 22.4 mmm180 -81.46 -46.65 14.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.492 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 1.0 OUTLIER -74.2 169.72 17.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.277 -0.889 . . . . 0.0 109.498 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.54 -52.87 7.28 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.0 -162.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -1.169 . . . . 0.0 109.421 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 179.5 80.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.297 -0.877 . . . . 0.0 109.449 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -152.82 -39.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.527 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -144.13 168.11 20.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.587 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.899 HD22 ' HB3' ' A' ' 31' ' ' GLU . 56.6 mt -86.17 152.08 23.12 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.339 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -119.16 69.45 0.82 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.777 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HD3' ' N ' ' A' ' 30' ' ' SER . 1.6 tmtt? 64.48 -81.6 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.518 -0.739 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.53 ' N ' ' HD3' ' A' ' 29' ' ' LYS . 4.3 m -48.28 -32.4 7.25 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.87 -1.144 . . . . 0.0 110.187 -179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.899 ' HB3' HD22 ' A' ' 27' ' ' LEU . 7.4 mm-40 -64.5 -43.01 95.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.962 -1.086 . . . . 0.0 108.568 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.651 HD22 HD13 ' A' ' 27' ' ' LEU . 3.2 mm? -55.93 -61.45 2.37 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.977 ' HG3' HG11 ' A' ' 53' ' ' VAL . 2.3 ttmt -52.15 -36.58 51.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.44 -0.788 . . . . 0.0 109.829 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -38.44 79.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 0.0 109.534 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.758 HD23 ' CE2' ' A' ' 76' ' ' PHE . 13.3 tp -75.14 -38.68 60.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.338 -0.851 . . . . 0.0 109.995 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.911 HG23 HD22 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -75.75 -14.16 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 109.744 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.474 ' HA ' ' OG ' ' A' ' 41' ' ' SER . 3.0 m120 -93.82 -57.02 2.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.973 -1.08 . . . . 0.0 109.756 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -73.92 -10.94 60.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.236 -0.915 . . . . 0.0 109.723 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.802 ' C ' HD12 ' A' ' 40' ' ' LEU . 2.5 mm-40 -121.01 -33.31 3.76 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.065 -1.022 . . . . 0.0 109.968 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.028 ' HB3' HD21 ' A' ' 44' ' ' LEU . 7.4 mp -117.9 66.0 0.75 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.047 -1.033 . . . . 0.0 109.606 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.479 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 7.7 m -138.99 26.88 2.42 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -0.878 . . . . 0.0 109.374 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -164.68 -47.57 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.214 -0.929 . . . . 0.0 109.488 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.477 ' HD2' ' HE3' ' B' ' 7' ' ' MET . 3.8 t80 -65.63 -71.89 0.17 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.028 HD21 ' HB3' ' A' ' 40' ' ' LEU . 0.6 OUTLIER -78.65 -148.47 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.225 -0.922 . . . . 0.0 109.27 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.645 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.1 mm-40 -90.05 107.92 19.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.156 -0.965 . . . . 0.0 109.382 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 41' ' ' SER . 2.0 mt-10 -43.73 158.16 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.31 -0.869 . . . . 0.0 109.244 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 1.053 HD12 HG23 ' A' ' 53' ' ' VAL . 24.3 mm -69.24 -53.7 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.206 -0.934 . . . . 0.0 109.434 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.7 pttt 39.7 25.22 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.666 -0.646 . . . . 0.0 111.185 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 mt-10 161.13 34.07 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.998 -1.063 . . . . 0.0 110.244 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.747 ' N ' HG22 ' A' ' 47' ' ' ILE . 32.0 mt-30 40.33 37.11 0.39 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.278 -0.889 . . . . 0.0 109.748 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -68.45 -70.51 0.26 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.157 -0.964 . . . . 0.0 109.627 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 1.3 t -80.86 -9.78 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.058 -1.026 . . . . 0.0 109.158 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.053 HG23 HD12 ' A' ' 47' ' ' ILE . 55.9 t -80.83 -45.91 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.19 -0.944 . . . . 0.0 108.939 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.14 -28.3 60.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.457 -0.777 . . . . 0.0 108.959 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -56.33 4.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.39 -0.819 . . . . 0.0 109.257 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 1.1 HG11 HG22 ' A' ' 80' ' ' VAL . 17.1 m -57.08 -48.15 82.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.054 -1.029 . . . . 0.0 109.542 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.608 ' N ' HG23 ' A' ' 56' ' ' VAL . 19.1 tpp -42.89 -45.14 4.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.205 -0.934 . . . . 0.0 109.68 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.77 -49.25 73.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.18 -0.95 . . . . 0.0 109.489 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.583 HG21 ' SD ' ' A' ' 79' ' ' MET . 4.5 t -77.53 -8.97 58.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.288 -0.883 . . . . 0.0 109.913 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 32' ' ' LEU . 13.2 mt -97.27 11.58 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 109.397 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -77.97 113.88 16.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.245 -0.909 . . . . 0.0 109.511 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.422 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 39.1 t30 -60.28 -50.37 73.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 109.477 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -150.35 16.5 0.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.176 -0.953 . . . . 0.0 109.589 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.08 75.18 1.29 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -176.98 30.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -1.163 . . . . 0.0 108.406 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 49.31 22.43 3.52 Favored Glycine 0 N--CA 1.482 1.758 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.3 mt-10 -106.76 96.57 6.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -1.141 . . . . 0.0 109.436 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.516 ' SG ' HD21 ' A' ' 32' ' ' LEU . 56.3 m -69.97 162.25 28.46 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.218 -0.926 . . . . 0.0 109.835 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.49 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 20.9 t70 -128.18 170.95 12.4 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -52.55 -51.22 60.74 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.093 -1.004 . . . . 0.0 110.203 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 0.5 OUTLIER -54.82 -30.6 57.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.28 -0.887 . . . . 0.0 109.103 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' CD2' ' A' ' 60' ' ' LEU . 3.8 mt-10 -82.52 -24.87 33.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' B' ' 3' ' ' LEU . 1.2 t80 -63.93 -57.55 9.44 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.121 -0.987 . . . . 0.0 108.642 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.909 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.1 OUTLIER -64.15 -48.88 74.33 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.343 -0.848 . . . . 0.0 108.763 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -55.52 -25.16 35.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.878 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -67.29 -69.41 0.31 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.438 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.878 HG23 ' CE2' ' A' ' 76' ' ' PHE . 40.0 t -53.45 -21.11 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.408 -0.807 . . . . 0.0 109.057 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.866 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.05 -50.29 64.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.332 -0.855 . . . . 0.0 109.484 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.657 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 44.8 mtp -73.6 -63.56 1.18 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.62 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 1.1 HG22 HG11 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -47.32 -22.83 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.842 0 O-C-N 120.565 -1.335 . . . . 0.0 109.41 -179.059 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.3 m -80.32 -68.83 0.64 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.03 -1.044 . . . . 0.0 109.123 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.8 t -74.32 -49.46 22.87 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.98 -1.075 . . . . 0.0 109.088 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.19 -31.08 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.421 0.629 . . . . 0.0 109.607 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' SG ' ' CG ' ' A' ' 45' ' ' GLU . 10.9 t -81.03 -58.36 3.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.0 109.288 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -45.05 -60.99 1.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.279 -0.888 . . . . 0.0 109.482 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -53.42 -47.53 69.53 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.39 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 58.8 t80 -46.67 -39.02 10.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.516 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -62.68 -53.66 51.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.231 -0.918 . . . . 0.0 109.442 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' A' ' 90' ' ' HIS . 5.0 mt-10 -63.17 169.9 3.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 109.408 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.46 ' O ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER 61.45 135.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.0 109.46 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.509 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.661 ' HG3' HG23 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -70.96 -70.08 0.33 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.92 . . . . 0.0 109.485 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.918 HD21 HG21 ' A' ' 13' ' ' VAL . 3.3 mm? -75.12 -17.59 60.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.26 -0.9 . . . . 0.0 109.393 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' B' ' 7' ' ' MET . 22.5 tt0 -73.36 -61.72 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.418 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.612 ' O ' HG12 ' B' ' 8' ' ' VAL . 7.4 ttmt -61.0 -51.19 70.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -58.86 -15.76 14.09 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.505 ' SD ' ' CD1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -82.29 -53.86 5.7 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.612 HG12 ' O ' ' B' ' 5' ' ' LYS . 9.4 p -55.7 -28.55 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.241 -0.912 . . . . 0.0 109.545 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.753 ' HB1' ' HB2' ' A' ' 2' ' ' GLU . . . -78.47 -62.91 1.53 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.607 ' O ' HG12 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -50.71 -21.71 1.74 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.931 . . . . 0.0 109.557 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 73.8 mt -77.02 -62.43 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -48.17 -23.39 0.84 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.231 -0.918 . . . . 0.0 109.535 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.867 HG21 HD11 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -81.61 -40.38 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.513 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.561 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 28.1 t80 -57.05 -50.5 72.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.12 -0.987 . . . . 0.0 109.254 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.475 ' HA ' ' HB2' ' B' ' 18' ' ' SER . 0.6 OUTLIER -67.85 -35.92 79.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.412 179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -51.56 -57.45 9.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.484 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.935 ' CD2' HD21 ' B' ' 35' ' ' LEU . 78.8 m-85 -64.82 -28.05 69.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.225 -0.922 . . . . 0.0 109.482 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 0.6 OUTLIER -65.72 -20.94 66.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.925 . . . . 0.0 109.521 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.51 16.99 59.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 29.5 mmt180 -90.08 -57.48 2.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.256 -1.143 . . . . 0.0 109.432 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 165.73 23.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.297 -0.877 . . . . 0.0 109.409 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.11 -122.59 5.86 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' HB2' ' HE2' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -94.03 -156.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.292 -1.122 . . . . 0.0 109.517 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' B' ' 25' ' ' HIS . 13.0 mtmm -132.46 28.09 4.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 31.0 m-70 -162.46 26.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.268 -0.895 . . . . 0.0 109.47 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.06 143.59 2.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.283 -0.885 . . . . 0.0 109.445 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.708 HD12 ' CB ' ' B' ' 31' ' ' GLU . 0.9 OUTLIER -93.24 167.27 11.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.957 . . . . 0.0 109.555 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.1 OUTLIER -135.7 80.58 1.84 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.388 -0.82 . . . . 0.0 109.369 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 64.0 -84.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.74 . . . . 0.0 110.32 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 29' ' ' LYS . 2.5 m -41.71 -57.51 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.136 -0.978 . . . . 0.0 110.482 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.708 ' CB ' HD12 ' B' ' 27' ' ' LEU . 64.7 mm-40 -61.15 -33.07 72.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.897 -1.127 . . . . 0.0 109.597 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.655 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 52.4 mt -56.0 -68.87 0.17 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.386 -0.821 . . . . 0.0 108.847 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.559 ' CD ' HG11 ' B' ' 53' ' ' VAL . 2.8 mttt -44.15 -33.88 1.66 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.32 -0.863 . . . . 0.0 109.073 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -58.73 -66.57 0.48 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.478 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.935 HD21 ' CD2' ' B' ' 17' ' ' TYR . 4.2 mm? -42.7 -40.65 2.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.88 . . . . 0.0 109.737 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.827 HD11 ' CZ ' ' B' ' 76' ' ' PHE . 2.8 mm -59.92 -50.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.227 -0.92 . . . . 0.0 109.687 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.573 ' ND2' ' O ' ' B' ' 44' ' ' LEU . 0.9 OUTLIER -81.14 6.29 14.25 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.235 -0.915 . . . . 0.0 109.612 -179.764 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -127.44 7.03 6.35 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.184 -0.947 . . . . 0.0 109.714 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.869 ' CD ' HG22 ' B' ' 77' ' ' VAL . 5.8 pt-20 -142.87 -33.74 0.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.177 -0.952 . . . . 0.0 110.155 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 1.018 ' CD1' HD13 ' B' ' 44' ' ' LEU . 3.8 mm? -52.55 -69.07 0.12 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.016 -1.052 . . . . 0.0 109.403 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.9 p 162.24 -54.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.397 -0.815 . . . . 0.0 109.389 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.511 ' CD2' ' N ' ' B' ' 43' ' ' PHE . 2.9 p-80 178.73 -36.97 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 109.363 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.511 ' N ' ' CD2' ' B' ' 42' ' ' HIS . 5.5 m-85 -60.75 -26.56 67.31 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.246 -0.909 . . . . 0.0 109.419 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 1.018 HD13 ' CD1' ' B' ' 40' ' ' LEU . 1.0 OUTLIER -100.88 31.14 3.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.427 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' B' ' 37' ' ' ASN . 88.0 tt0 -47.1 -46.79 23.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.446 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.531 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 1.2 pm0 -129.95 16.69 5.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.282 -0.886 . . . . 0.0 109.418 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.727 HG21 ' HA ' ' B' ' 50' ' ' GLN . 14.5 mm 82.7 -19.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.678 -0.639 . . . . 0.0 110.247 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 84.58 -36.28 0.06 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.392 -0.818 . . . . 0.0 109.82 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.539 ' N ' ' HG2' ' B' ' 48' ' ' LYS . 5.0 tt0 178.46 33.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.076 -1.015 . . . . 0.0 109.48 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.727 ' HA ' HG21 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 50.14 51.32 16.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.13 -57.28 2.91 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.635 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.838 HG11 ' HA ' ' B' ' 80' ' ' VAL . 40.1 t -86.97 -13.58 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.655 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.679 HG21 HG13 ' B' ' 47' ' ' ILE . 37.7 t -77.47 -15.62 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 120.902 -1.124 . . . . 0.0 109.339 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -48.84 6.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.327 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -72.31 -42.04 65.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.874 . . . . 0.0 109.383 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.978 HG21 ' CE1' ' B' ' 76' ' ' PHE . 5.4 p -56.4 -46.48 81.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.203 -0.936 . . . . 0.0 109.386 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.655 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 8.1 tpp -42.79 -47.1 5.43 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.416 -0.802 . . . . 0.0 109.169 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.447 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.9 OUTLIER -57.14 -45.11 83.81 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.749 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.712 HG22 ' O ' ' B' ' 56' ' ' VAL . 3.9 t -75.14 -12.24 60.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.0 110.077 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.605 HD21 ' CG ' ' B' ' 76' ' ' PHE . 34.1 mt -91.12 -9.03 47.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.34 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 17.1 p-10 -62.6 113.39 2.96 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.276 -0.89 . . . . 0.0 109.576 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.516 ' CA ' ' OE2' ' B' ' 72' ' ' GLU . 9.1 p-10 -81.17 -45.89 15.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.266 -0.896 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.43 ' N ' ' CG ' ' B' ' 62' ' ' ASN . 0.6 OUTLIER -131.77 1.0 3.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 75.51 1.2 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -175.3 29.83 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -1.156 . . . . 0.0 108.385 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.3 26.26 6.6 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.454 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 87.0 mt-10 -105.76 111.95 24.83 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -1.136 . . . . 0.0 109.437 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 16.2 t -69.64 159.02 34.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.493 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.3 OUTLIER -130.03 172.54 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.424 -0.797 . . . . 0.0 109.249 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.467 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.2 OUTLIER -58.33 -53.56 56.88 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.377 -0.827 . . . . 0.0 110.466 -179.667 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.714 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.87 -40.55 89.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.28 -0.887 . . . . 0.0 108.611 -179.836 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.516 ' OE2' ' CA ' ' B' ' 62' ' ' ASN . 0.3 OUTLIER -76.48 -12.07 59.98 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.442 -0.786 . . . . 0.0 109.083 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.561 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 8.5 t80 -73.26 -57.99 3.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.866 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.51 -45.72 90.91 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.102 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -60.02 -33.18 71.65 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.353 -0.842 . . . . 0.0 108.784 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.978 ' CE1' HG21 ' B' ' 56' ' ' VAL . 1.0 OUTLIER -57.26 -70.03 0.14 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.014 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.869 HG22 ' CD ' ' B' ' 39' ' ' GLU . 6.7 t -50.22 -32.34 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.468 -0.77 . . . . 0.0 109.31 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.909 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -58.98 -45.55 90.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 109.867 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.695 ' HE3' HG21 ' B' ' 59' ' ' THR . 2.7 mpp? -76.46 -68.4 0.6 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.197 -0.94 . . . . 0.0 109.825 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.838 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.29 -24.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.452 -1.405 . . . . 0.0 109.441 -179.239 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.504 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 8.5 m -77.7 -68.1 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.051 -1.031 . . . . 0.0 108.916 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -79.08 -49.65 12.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 108.798 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.69 -37.43 0.22 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.742 -0.599 . . . . 0.0 109.789 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 43.3 t -72.96 -48.31 37.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.3 -0.875 . . . . 0.0 109.47 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.66 -10.06 32.86 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.243 -0.911 . . . . 0.0 109.473 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -38.52 69.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 0.0 109.411 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.82 -32.55 63.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.305 -0.872 . . . . 0.0 109.442 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.494 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 0.3 OUTLIER -57.62 -40.46 79.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.439 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.494 ' CB ' ' O ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER 76.58 -79.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.55 -161.74 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.194 -0.941 . . . . 0.0 109.456 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.484 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 29.6 t . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.371 0.605 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.32 -70.67 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 109.913 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.92 HD22 ' OE2' ' B' ' 39' ' ' GLU . 6.0 mt -78.51 -33.13 48.3 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.118 -0.989 . . . . 0.0 110.02 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 11.5 tt0 -57.77 -59.97 4.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.086 -1.008 . . . . 0.0 109.246 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.17 -53.21 59.86 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.347 -0.845 . . . . 0.0 109.469 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -61.24 -12.84 14.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.295 -0.878 . . . . 0.0 109.671 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.781 ' O ' HD12 ' A' ' 11' ' ' ILE . 4.9 ttp -80.29 -60.43 2.33 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.172 -0.955 . . . . 0.0 109.435 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 8' ' ' VAL . 4.2 t -55.01 -27.89 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.482 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -77.82 -64.31 1.18 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.63 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.52 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.2 OUTLIER -43.3 -53.4 5.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 0.0 109.754 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.781 HD12 ' O ' ' A' ' 7' ' ' MET . 2.1 mp -59.24 -45.88 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.275 -0.891 . . . . 0.0 109.583 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 0.5 OUTLIER -55.74 -23.48 29.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.195 -0.941 . . . . 0.0 109.413 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.868 ' CG1' HD21 ' A' ' 35' ' ' LEU . 1.2 t -89.13 -27.09 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.259 -0.901 . . . . 0.0 109.231 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.583 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 10.3 t80 -64.67 -42.4 95.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.012 -1.055 . . . . 0.0 109.057 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.426 ' O ' ' N ' ' A' ' 19' ' ' GLY . 65.0 m170 -82.4 -44.37 16.18 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.325 -0.859 . . . . 0.0 109.518 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -52.8 -59.44 4.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.512 ' CD1' HG13 ' A' ' 13' ' ' VAL . 34.6 m-85 -61.85 -45.76 92.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.891 . . . . 0.0 109.616 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.758 ' OG ' HD12 ' A' ' 27' ' ' LEU . 48.2 m -72.26 -3.08 21.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.772 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 15' ' ' HIS . . . -75.1 -9.16 83.95 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HD3' ' OE2' ' A' ' 31' ' ' GLU . 16.9 mtt85 -87.93 -34.68 18.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.305 -1.115 . . . . 0.0 109.462 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 8.9 tt0 -69.94 154.4 42.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.299 -0.876 . . . . 0.0 109.381 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -43.49 -26.94 0.73 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' OD2' ' HD3' ' A' ' 26' ' ' LYS . 37.1 t70 -112.34 135.62 52.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 18' ' ' SER . 6.4 ptmt -91.99 70.91 5.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.287 -0.883 . . . . 0.0 109.571 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.576 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.5 OUTLIER -170.2 -34.79 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -118.75 151.05 38.74 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.975 . . . . 0.0 109.785 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.863 HD22 HD23 ' A' ' 32' ' ' LEU . 7.2 mp -89.77 165.92 13.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.232 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 10.4 pttp -122.47 69.94 0.98 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.203 -0.935 . . . . 0.0 109.634 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' A' ' 30' ' ' SER . 0.3 OUTLIER 62.18 -84.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.453 -0.779 . . . . 0.0 110.339 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.496 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 7.9 t -46.1 -42.22 13.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.169 -0.957 . . . . 0.0 110.445 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.789 ' C ' HD23 ' A' ' 27' ' ' LEU . 67.5 mm-40 -56.77 -42.46 79.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.906 -1.121 . . . . 0.0 109.146 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.94 HD13 HD12 ' A' ' 60' ' ' LEU . 33.1 mt -60.15 -65.53 0.67 Allowed 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.528 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 2.4 ttpp -40.8 -29.61 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.369 -0.832 . . . . 0.0 109.52 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -66.81 -58.1 5.72 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.322 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.868 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.8 -29.08 17.66 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.36 -0.837 . . . . 0.0 109.569 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.738 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.0 mp -74.46 -40.02 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.148 -0.97 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.528 ' ND2' ' HG3' ' A' ' 33' ' ' LYS . 73.2 m-80 -90.19 6.1 44.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 109.689 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.71 -37.58 5.63 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 109.414 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.521 ' OE1' HD22 ' B' ' 3' ' ' LEU . 1.9 pt-20 -111.76 -25.82 9.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.315 -0.866 . . . . 0.0 109.327 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.042 HD22 HD21 ' A' ' 44' ' ' LEU . 89.2 mt -108.28 69.44 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.29 7.44 8.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -130.8 0.01 4.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.219 -0.926 . . . . 0.0 109.643 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.592 ' HB3' HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -119.64 -54.93 2.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.158 -0.964 . . . . 0.0 109.486 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.042 HD21 HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -100.22 25.97 7.0 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.25 -0.906 . . . . 0.0 109.426 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 47' ' ' ILE . 1.4 mt-10 43.1 71.8 0.21 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.307 -0.871 . . . . 0.0 109.581 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.81 ' O ' HD13 ' A' ' 47' ' ' ILE . 3.1 mt-10 52.38 -90.17 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.882 . . . . 0.0 109.255 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.904 HD12 HG21 ' A' ' 53' ' ' VAL . 5.5 mm -133.15 -39.96 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.283 -0.885 . . . . 0.0 109.332 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 85.53 -32.15 0.05 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.814 -0.554 . . . . 0.0 109.767 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 3.2 mt-10 162.52 64.7 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.193 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.2 OUTLIER 33.45 48.35 0.18 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.247 0.546 . . . . 0.0 110.045 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' OE1' ' C ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -90.05 -62.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.347 -0.846 . . . . 0.0 109.772 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.933 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.6 t -88.35 -14.33 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.072 -1.017 . . . . 0.0 109.92 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.904 HG21 HD12 ' A' ' 47' ' ' ILE . 27.4 t -84.01 -28.43 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.832 -1.167 . . . . 0.0 108.68 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.69 -33.23 20.11 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.27 -0.894 . . . . 0.0 108.773 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -51.43 7.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.82 . . . . 0.0 108.974 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.905 HG22 HD21 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -60.62 -41.87 89.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 O-C-N 121.159 -0.963 . . . . 0.0 108.896 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.77 ' SD ' HD12 ' A' ' 32' ' ' LEU . 7.1 tpt -42.01 -50.02 4.64 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.595 -0.69 . . . . 0.0 109.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -43.85 88.28 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.233 -0.917 . . . . 0.0 108.942 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.526 HG21 ' SD ' ' A' ' 79' ' ' MET . 15.8 m -62.23 -23.8 66.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.359 -0.838 . . . . 0.0 109.652 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.94 HD12 HD13 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -85.66 -27.43 25.38 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.13 -0.981 . . . . 0.0 109.275 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.613 ' OD1' ' HE2' ' A' ' 57' ' ' MET . 82.2 m-20 -63.41 114.08 3.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.224 -0.922 . . . . 0.0 109.51 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.4 ' HA ' ' OE2' ' A' ' 72' ' ' GLU . 5.5 t-20 -47.95 -43.08 28.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 109.425 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.99 25.82 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.441 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.16 88.84 2.04 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.11 -34.43 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.2 -1.177 . . . . 0.0 108.622 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 27' ' ' LEU . . . 110.1 -19.02 27.96 Favored Glycine 0 N--CA 1.485 1.947 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.415 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 26.8 mt-10 -73.11 97.4 2.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 109.541 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 12.9 t -69.79 154.28 42.18 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.198 -0.939 . . . . 0.0 109.619 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.482 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -113.32 171.33 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.806 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.522 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.1 OUTLIER -61.39 -50.13 74.11 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.229 -0.919 . . . . 0.0 110.091 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.548 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 4.4 mp0 -54.83 -40.05 69.2 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.316 -0.865 . . . . 0.0 109.145 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 60' ' ' LEU . 2.4 mt-10 -79.69 -17.82 52.74 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.306 -0.871 . . . . 0.0 109.663 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.743 ' CZ ' HD21 ' B' ' 3' ' ' LEU . 22.1 t80 -69.56 -54.72 12.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.07 -1.019 . . . . 0.0 108.84 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.693 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 1.6 ttm -64.42 -44.4 91.35 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.278 -0.889 . . . . 0.0 108.787 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' ' CE ' ' A' ' 79' ' ' MET . . . -64.04 -25.11 67.97 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.303 -0.873 . . . . 0.0 108.817 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.09 -65.72 0.64 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 HD23 ' B' ' 3' ' ' LEU . 39.9 t -61.31 -22.14 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.885 . . . . 0.0 108.95 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.797 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.42 -40.97 89.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.365 -0.834 . . . . 0.0 109.341 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.651 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 49.3 mtm -78.02 -66.26 0.87 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.281 -0.887 . . . . 0.0 109.42 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.933 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.48 -22.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 O-C-N 120.474 -1.391 . . . . 0.0 109.462 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.495 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 6.2 m -80.67 -68.0 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.002 -1.061 . . . . 0.0 109.096 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.557 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.4 t -75.94 -49.33 18.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.0 109.089 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.52 -40.89 0.27 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.707 -0.621 . . . . 0.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.4 t -77.4 -42.57 35.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -0.906 . . . . 0.0 109.523 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 82' ' ' THR . 1.4 t60 -64.44 -11.0 28.85 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.219 -0.926 . . . . 0.0 109.522 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -39.04 21.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.286 -0.884 . . . . 0.0 109.504 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -54.24 -51.41 64.58 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.256 -0.903 . . . . 0.0 109.502 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -24.33 67.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.185 -0.947 . . . . 0.0 109.475 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -49.61 56.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.244 -0.91 . . . . 0.0 109.489 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -179.68 4.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.283 -0.885 . . . . 0.0 109.51 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.97 -1.014 . . . . 0.0 109.453 -179.984 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.526 ' HB2' HG21 ' A' ' 13' ' ' VAL . 2.1 mp0 -72.74 -69.26 0.42 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.423 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.971 HD23 HG21 ' A' ' 77' ' ' VAL . 6.2 mp -65.39 -11.16 39.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.905 . . . . 0.0 109.468 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.987 ' O ' HG23 ' B' ' 8' ' ' VAL . 30.9 tt0 -73.83 -62.58 1.45 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.219 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.47 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -65.39 -36.55 84.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.268 -0.895 . . . . 0.0 109.135 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.27 -66.46 0.54 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.308 -0.87 . . . . 0.0 109.433 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.483 ' O ' HG12 ' B' ' 11' ' ' ILE . 0.4 OUTLIER -45.3 -30.81 1.36 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.309 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.987 HG23 ' O ' ' B' ' 4' ' ' GLU . 79.6 t -60.64 -55.61 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.122 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -44.92 87.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.177 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.741 ' CD1' HD23 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -58.76 -26.44 64.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.312 -0.868 . . . . 0.0 109.34 179.824 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.927 HD13 ' CZ ' ' B' ' 70' ' ' PHE . 9.0 mm -70.08 -48.29 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.267 -0.895 . . . . 0.0 109.108 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.8 OUTLIER -65.43 -19.03 65.77 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.49 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.559 HG11 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -88.22 -30.85 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.227 -0.92 . . . . 0.0 109.338 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 18.8 t80 -67.91 -46.07 72.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.02 -1.05 . . . . 0.0 109.214 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 53.6 m170 -79.53 -34.24 41.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.242 -0.911 . . . . 0.0 109.64 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -62.7 -61.75 2.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 109.455 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.961 ' CG ' HD21 ' B' ' 35' ' ' LEU . 35.9 m-85 -58.19 -44.58 88.14 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.233 -0.917 . . . . 0.0 109.614 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.473 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 83.4 p -67.0 -18.88 65.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.565 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.85 13.73 66.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.529 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.07 -38.24 13.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -1.158 . . . . 0.0 109.435 179.977 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -166.05 140.36 4.46 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 109.468 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 23' ' ' ASP . . . 84.28 -149.39 24.95 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.452 ' O ' ' O ' ' B' ' 18' ' ' SER . 4.0 p30 -54.75 -169.55 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.8 ptpt -134.12 11.85 3.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.407 ' C ' ' HD3' ' B' ' 26' ' ' LYS . 18.2 m80 -138.27 7.15 2.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 109.595 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -143.07 170.14 16.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.701 HD23 ' C ' ' B' ' 31' ' ' GLU . 4.2 mp -121.96 139.26 53.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.165 -0.959 . . . . 0.0 110.3 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.523 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 14.7 tttm -86.18 156.95 20.11 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' B' ' 32' ' ' LEU . 11.8 mttt -37.46 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.062 -1.023 . . . . 0.0 109.987 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.521 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.5 OUTLIER -79.0 -45.95 19.19 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.701 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.2 OUTLIER -58.47 -40.26 82.22 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 120.808 -1.182 . . . . 0.0 108.776 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.919 HD21 ' SG ' ' B' ' 68' ' ' CYS . 2.6 mt -59.12 -63.4 1.32 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.746 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -39.97 -44.21 1.67 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.514 -0.741 . . . . 0.0 109.871 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.46 -61.04 2.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.961 HD21 ' CG ' ' B' ' 17' ' ' TYR . 2.4 mm? -49.29 -58.56 4.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -0.864 . . . . 0.0 109.804 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.982 HD12 HG22 ' B' ' 53' ' ' VAL . 0.7 OUTLIER -43.23 -35.34 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.31 -0.869 . . . . 0.0 109.739 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.498 ' HA ' ' HA ' ' B' ' 43' ' ' PHE . 22.6 m120 -73.67 -54.8 7.28 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 110.142 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' B' ' 38' ' ' ASN . 1.5 m120 -96.29 27.59 3.66 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.171 -0.956 . . . . 0.0 109.579 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.92 ' OE2' HD22 ' A' ' 3' ' ' LEU . 21.5 tt0 -127.79 -37.79 1.92 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.236 -0.915 . . . . 0.0 109.321 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.3 mm? -73.02 -56.26 5.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.313 -0.867 . . . . 0.0 109.285 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 5.4 t 161.34 -56.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.499 -0.75 . . . . 0.0 108.978 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.551 ' C ' ' CG ' ' B' ' 43' ' ' PHE . 2.6 p80 -138.43 56.14 1.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.765 ' C ' HD12 ' B' ' 44' ' ' LEU . 0.6 OUTLIER 40.43 34.81 0.25 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.551 -0.718 . . . . 0.0 109.555 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.828 ' N ' HD12 ' B' ' 44' ' ' LEU . 1.3 mp 44.45 -156.85 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.31 -0.868 . . . . 0.0 109.202 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.31 57.89 4.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.308 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 0.4 OUTLIER 66.74 25.74 9.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.283 -0.886 . . . . 0.0 109.048 -179.718 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.805 HD12 HG23 ' B' ' 53' ' ' VAL . 23.3 mm 62.58 12.18 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.432 -0.793 . . . . 0.0 109.561 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.481 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 42.98 26.2 0.07 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.08 -1.012 . . . . 0.0 109.577 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.481 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.4 tt0 75.02 87.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.115 -0.991 . . . . 0.0 109.83 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.478 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 42.39 50.66 4.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.322 -0.861 . . . . 0.0 109.839 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.491 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.5 tp10 -91.2 -70.57 0.68 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.174 -0.954 . . . . 0.0 109.705 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 1.023 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.0 t -91.51 -15.04 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.182 -0.949 . . . . 0.0 109.38 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.982 HG22 HD12 ' B' ' 36' ' ' ILE . 62.3 t -84.28 -30.01 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 120.966 -1.084 . . . . 0.0 108.594 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 10.1 t0 -90.18 -29.08 18.47 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.308 -0.87 . . . . 0.0 108.873 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 10.5 mtmt -85.27 -47.93 9.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.392 -0.817 . . . . 0.0 109.23 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.918 HG22 HD21 ' B' ' 60' ' ' LEU . 0.6 OUTLIER -65.66 -40.67 88.61 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.124 -0.985 . . . . 0.0 109.006 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.84 ' SD ' HD13 ' B' ' 32' ' ' LEU . 8.0 tpt -39.9 -52.53 2.39 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.763 -0.586 . . . . 0.0 109.723 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.73 -42.27 96.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.196 -0.94 . . . . 0.0 108.863 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.409 ' N ' ' O ' ' B' ' 56' ' ' VAL . 96.6 m -62.22 -20.51 64.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.363 -0.836 . . . . 0.0 109.799 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.918 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -85.33 -73.62 0.43 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.041 -1.037 . . . . 0.0 109.189 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.46 ' HA ' ' OE1' ' B' ' 72' ' ' GLU . 9.8 t70 -84.64 93.12 8.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.28 -0.888 . . . . 0.0 109.547 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.29 10.74 40.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.907 . . . . 0.0 109.369 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -92.43 -41.84 10.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 109.558 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 90.05 2.1 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -172.87 -37.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.293 -1.122 . . . . 0.0 108.463 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 32.88 3.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 5.2 mt-10 -144.9 113.11 6.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.255 -1.144 . . . . 0.0 109.361 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.919 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.86 151.18 46.0 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.202 -0.936 . . . . 0.0 109.904 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.497 ' HB3' ' HG3' ' B' ' 72' ' ' GLU . 4.5 t70 -112.46 171.29 7.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -0.856 . . . . 0.0 108.724 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.927 ' CZ ' HD13 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -54.36 -53.0 59.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.225 -0.922 . . . . 0.0 110.491 -179.466 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.425 ' OE1' ' OD2' ' B' ' 69' ' ' ASP . 0.0 OUTLIER -56.61 -26.65 56.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.151 -0.968 . . . . 0.0 109.269 -179.716 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' B' ' 69' ' ' ASP . 6.5 mt-10 -85.58 -22.66 27.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 109.831 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.539 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 50.8 t80 -74.28 -40.41 62.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.09 -1.006 . . . . 0.0 108.943 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.797 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -75.6 -41.12 55.33 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.48 -0.762 . . . . 0.0 109.196 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.452 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -65.21 -30.95 71.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.15 -0.969 . . . . 0.0 108.861 179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.691 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -66.08 -63.37 1.1 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.449 -0.782 . . . . 0.0 108.944 179.691 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.564 ' N ' ' CG ' ' B' ' 76' ' ' PHE . 52.2 t -57.83 -26.78 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.189 -0.944 . . . . 0.0 109.351 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.693 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.09 -34.49 77.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.345 -0.847 . . . . 0.0 109.472 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.652 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.3 OUTLIER -82.86 -69.4 0.63 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 109.659 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 1.023 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.88 -23.78 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.549 -1.345 . . . . 0.0 109.334 -179.413 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 12.0 m -78.42 -67.74 0.71 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.561 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -78.22 -49.54 13.57 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.136 -0.977 . . . . 0.0 108.874 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.652 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.83 -36.38 0.11 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.769 -0.582 . . . . 0.0 109.82 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.3 t -90.03 -36.94 14.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.202 -0.936 . . . . 0.0 109.438 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.509 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 60.3 t60 -62.33 -12.95 23.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.95 -31.3 23.66 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.2 -0.938 . . . . 0.0 109.406 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -55.34 5.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -90.05 -43.98 10.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.271 -0.893 . . . . 0.0 109.511 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' B' ' 85' ' ' HIS . 2.6 tm-20 -60.02 131.46 50.93 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.235 -0.915 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.424 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 7.6 t60 69.37 124.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.458 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.437 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 16.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.518 ' HG2' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -74.31 -77.54 0.11 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.457 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.713 HD13 ' HG2' ' B' ' 39' ' ' GLU . 7.3 mp -66.91 -15.53 63.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.447 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.783 ' O ' HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -73.65 -63.02 1.29 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.378 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.449 ' O ' ' HD2' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -63.08 -34.18 77.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.249 -0.907 . . . . 0.0 109.356 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.518 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -66.44 -66.92 0.49 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 0.0 109.549 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.618 ' O ' HD12 ' A' ' 11' ' ' ILE . 6.8 ptm -43.93 -31.78 0.96 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 4' ' ' GLU . 71.5 t -62.4 -55.65 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.513 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.862 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -63.42 -57.72 9.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.504 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.148 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -44.04 -37.96 3.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 109.372 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.618 HD12 ' O ' ' A' ' 7' ' ' MET . 32.9 mt -64.64 -45.8 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.937 . . . . 0.0 109.36 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -58.27 -23.68 56.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.282 -0.886 . . . . 0.0 109.302 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -83.47 -38.6 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.264 -0.898 . . . . 0.0 109.398 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.0 t80 -59.56 -51.96 67.58 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 120.92 -1.112 . . . . 0.0 109.425 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -55.16 14.88 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.562 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -46.09 -69.47 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.221 -0.924 . . . . 0.0 109.605 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.58 ' CE1' ' HG ' ' A' ' 35' ' ' LEU . 41.3 m-85 -50.2 -27.67 6.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.248 -0.908 . . . . 0.0 109.561 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.484 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -62.52 -44.9 95.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 109.427 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -55.27 -18.52 14.05 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 27.8 mmm180 -68.14 -41.87 81.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.308 -1.113 . . . . 0.0 109.419 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.568 ' CG ' ' CD ' ' A' ' 28' ' ' LYS . 2.7 tm-20 -82.23 161.24 22.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.318 -0.864 . . . . 0.0 109.433 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -45.52 -51.04 10.11 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -94.97 167.33 11.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.232 -1.158 . . . . 0.0 109.402 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.526 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 11.4 mttt -118.13 86.96 2.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.294 -0.879 . . . . 0.0 109.522 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.9 t-80 -170.08 -35.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.911 . . . . 0.0 109.624 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 5.7 mtmt -140.05 170.11 16.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 ' HB3' ' A' ' 31' ' ' GLU . 82.5 mt -107.05 170.09 8.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.284 -0.885 . . . . 0.0 109.497 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.568 ' CD ' ' CG ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -128.97 73.59 1.52 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.141 -0.974 . . . . 0.0 109.917 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.853 ' HA ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttmt 62.35 -84.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.442 -0.786 . . . . 0.0 110.696 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.467 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.8 OUTLIER -43.81 -50.53 7.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.115 -0.991 . . . . 0.0 110.567 -179.058 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.772 ' HB3' HD22 ' A' ' 27' ' ' LEU . 6.1 mm-40 -52.69 -40.89 63.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.972 -1.08 . . . . 0.0 109.513 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 29' ' ' LYS . 14.2 mt -58.92 -65.89 0.59 Allowed 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.623 -0.673 . . . . 0.0 109.631 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.52 ' CA ' HG13 ' A' ' 36' ' ' ILE . 7.1 ttpp -38.47 -37.64 0.32 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.578 -0.701 . . . . 0.0 110.016 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.448 ' O ' ' OD1' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -65.9 -50.29 65.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -0.939 . . . . 0.0 109.474 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 13' ' ' VAL . 1.3 mt -60.93 -21.53 63.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 0.0 109.783 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.909 ' CD1' HG13 ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.25 -57.97 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.166 -0.959 . . . . 0.0 109.575 -179.75 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.467 ' OD1' ' HA ' ' A' ' 43' ' ' PHE . 70.3 m-80 -70.1 -5.18 25.1 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.19 -0.944 . . . . 0.0 109.67 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 34' ' ' GLU . 6.5 m120 -114.39 -8.75 12.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.186 -0.946 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.768 ' OE2' HG13 ' A' ' 77' ' ' VAL . 1.8 tm-20 -94.25 -46.91 6.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.175 -0.953 . . . . 0.0 109.584 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.669 HD22 ' N ' ' A' ' 40' ' ' LEU . 2.9 mm? -72.9 -52.35 15.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.215 -0.928 . . . . 0.0 109.555 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.428 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER 170.08 -60.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.155 -0.965 . . . . 0.0 109.656 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.457 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 68.6 m-70 -136.1 -57.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.192 -0.943 . . . . 0.0 109.459 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.857 ' C ' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -160.16 28.78 0.17 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.285 -0.885 . . . . 0.0 109.493 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.937 HD22 HG12 ' A' ' 80' ' ' VAL . 0.9 OUTLIER 46.39 -148.33 0.13 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 109.377 179.782 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.482 ' OE1' ' HG2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -48.68 -49.32 38.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.228 -0.92 . . . . 0.0 109.265 179.804 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.482 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 6.3 pt-20 167.78 88.18 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.907 HD11 HD13 ' A' ' 44' ' ' LEU . 6.1 mt -82.05 72.37 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.271 -0.893 . . . . 0.0 109.238 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -42.5 -34.79 0.9 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.355 -0.841 . . . . 0.0 109.444 179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' A' ' 50' ' ' GLN . 14.1 pt-20 178.37 -31.72 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.449 -0.782 . . . . 0.0 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 8.1 pt20 -159.72 29.98 0.19 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.266 -0.896 . . . . 0.0 109.759 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.473 ' OE1' ' HG3' ' A' ' 46' ' ' GLU . 1.8 mt-10 -60.79 -70.86 0.16 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.033 -1.042 . . . . 0.0 108.802 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.836 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -90.96 -12.72 9.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.909 HG13 ' CD1' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -76.91 -30.27 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 22.6 t70 -76.24 -47.18 24.85 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.278 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -50.54 63.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.296 -0.878 . . . . 0.0 109.394 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 1.013 HG11 HG22 ' A' ' 80' ' ' VAL . 24.0 m -57.78 -47.31 86.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.114 -0.991 . . . . 0.0 109.58 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.602 ' N ' HG23 ' A' ' 56' ' ' VAL . 9.9 tpt -38.21 -49.55 1.37 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.576 -0.702 . . . . 0.0 110.349 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -60.02 -46.1 90.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.12 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 59' ' ' THR . 28.6 m -73.18 -8.76 57.21 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.443 -0.786 . . . . 0.0 109.856 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.656 ' N ' HD23 ' A' ' 60' ' ' LEU . 1.9 mt -84.78 -27.68 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.166 -0.959 . . . . 0.0 109.324 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -43.73 110.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.537 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.521 ' CB ' ' OD1' ' A' ' 69' ' ' ASP . 33.2 t30 -60.1 -52.05 67.0 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.3 -0.875 . . . . 0.0 109.42 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -152.57 18.12 0.62 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.224 -0.922 . . . . 0.0 109.519 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.79 88.53 1.77 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.28 -36.66 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.301 -1.117 . . . . 0.0 108.525 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.2 -1.23 31.26 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -99.83 121.7 41.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.213 -1.169 . . . . 0.0 109.483 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.647 ' CB ' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -69.51 131.28 44.47 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.521 ' OD1' ' CB ' ' A' ' 62' ' ' ASN . 2.2 m-20 -110.27 170.66 7.93 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.579 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 1.2 t80 -52.96 -50.63 63.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.071 -1.018 . . . . 0.0 110.406 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.482 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 35.8 mt-30 -51.92 -46.48 64.66 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.501 -0.749 . . . . 0.0 109.752 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' HA ' ' A' ' 68' ' ' CYS . 0.5 OUTLIER -74.38 -18.6 60.65 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.095 -1.003 . . . . 0.0 109.695 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 1.148 ' CE2' HD23 ' A' ' 10' ' ' LEU . 10.5 t80 -63.17 -53.95 45.31 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.045 -1.034 . . . . 0.0 109.235 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.899 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.69 -46.21 66.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.975 ' CB ' ' HB2' ' B' ' 75' ' ' ALA . . . -56.18 -31.54 63.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.038 -1.039 . . . . 0.0 109.04 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.787 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -64.6 -65.05 0.73 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.787 HG23 ' CE2' ' A' ' 76' ' ' PHE . 41.3 t -56.55 -18.71 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.881 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -65.46 -48.92 71.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.353 -0.842 . . . . 0.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.9 OUTLIER -74.98 -64.16 1.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.354 -0.841 . . . . 0.0 109.745 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 1.013 HG22 HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.01 -22.01 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 O-C-N 120.407 -1.433 . . . . 0.0 109.627 -178.824 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.715 ' CG2' HD11 ' B' ' 11' ' ' ILE . 4.6 m -80.62 -65.8 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.91 -1.119 . . . . 0.0 108.876 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.7 t -80.1 -49.7 11.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.158 -0.963 . . . . 0.0 108.922 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.68 -33.77 0.08 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.607 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.466 ' SG ' ' HG2' ' A' ' 45' ' ' GLU . 11.9 t -74.17 -50.89 17.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.354 -0.841 . . . . 0.0 109.351 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -53.44 -55.69 23.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.922 . . . . 0.0 109.45 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -38.55 83.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 0.0 109.471 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -44.64 -33.36 1.78 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.63 -40.69 48.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.229 -0.92 . . . . 0.0 109.533 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.22 161.52 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.921 . . . . 0.0 109.483 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 -131.56 175.91 8.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 109.502 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.429 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.862 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -58.25 -75.13 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.254 -0.903 . . . . 0.0 109.66 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.807 HD21 ' HZ ' ' A' ' 73' ' ' PHE . 1.3 mt -75.58 -30.6 59.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 0.0 109.651 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 7' ' ' MET . 16.9 mt-10 -57.36 -59.1 5.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -0.954 . . . . 0.0 109.301 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' B' ' 1' ' ' SER . 1.0 OUTLIER -60.71 -49.66 76.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.291 -0.881 . . . . 0.0 109.378 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.562 ' HB1' HD12 ' A' ' 10' ' ' LEU . . . -66.0 -9.83 33.99 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.274 -0.891 . . . . 0.0 109.449 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' B' ' 3' ' ' LEU . 2.6 ttp -80.71 -53.84 6.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.436 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.97 -36.44 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.373 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.12 -46.72 64.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.203 -0.936 . . . . 0.0 109.469 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.587 ' HB3' ' HE1' ' B' ' 74' ' ' MET . 6.3 mt -61.3 -66.84 0.47 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.903 . . . . 0.0 109.427 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.715 HD11 ' CG2' ' A' ' 81' ' ' THR . 61.3 mt -41.76 -40.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.402 -0.811 . . . . 0.0 109.327 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 29.7 t70 -58.59 -54.06 51.37 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.26 -0.9 . . . . 0.0 109.066 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.692 HG21 HD13 ' A' ' 3' ' ' LEU . 1.7 t -51.5 -25.94 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.375 -0.828 . . . . 0.0 109.504 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.58 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 10.0 t80 -72.08 -46.39 57.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.897 -1.127 . . . . 0.0 109.666 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.522 ' NE2' ' HD3' ' B' ' 24' ' ' LYS . 43.9 t-80 -78.04 -14.68 59.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.262 -0.899 . . . . 0.0 110.454 -179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.525 ' O ' ' CG ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -90.41 -60.16 2.0 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.947 -1.096 . . . . 0.0 109.287 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.579 ' CD2' ' OE1' ' B' ' 34' ' ' GLU . 24.6 m-85 -61.63 -33.23 73.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.522 -0.736 . . . . 0.0 109.623 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.531 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 4.2 p -82.87 -11.35 58.28 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.172 -0.955 . . . . 0.0 109.658 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -102.77 9.31 55.26 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.525 ' CG ' ' O ' ' B' ' 16' ' ' GLN . 11.0 mtp85 -89.98 -33.95 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -1.159 . . . . 0.0 109.476 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.476 ' HG2' ' OE2' ' B' ' 31' ' ' GLU . 5.6 pt-20 -170.17 117.44 0.55 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.905 . . . . 0.0 109.384 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.54 -81.13 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' B' ' 24' ' ' LYS . 3.2 p30 -171.57 28.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -1.147 . . . . 0.0 109.555 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.522 ' HD3' ' NE2' ' B' ' 15' ' ' HIS . 1.6 ttmt 43.65 61.2 2.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.893 . . . . 0.0 109.508 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.508 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.2 OUTLIER -170.1 -34.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 0.0 109.678 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.531 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.0 OUTLIER -141.12 165.25 28.05 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.203 -0.935 . . . . 0.0 109.708 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 1.08 HD12 HD23 ' B' ' 32' ' ' LEU . 17.8 mt -87.77 148.76 24.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.303 -0.873 . . . . 0.0 109.262 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -116.55 72.64 0.82 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.688 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 62.32 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.461 -0.775 . . . . 0.0 110.578 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 0.3 OUTLIER -48.32 -37.52 16.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.197 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.665 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.9 mm-40 -58.27 -41.22 83.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.085 -1.009 . . . . 0.0 109.48 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 1.08 HD23 HD12 ' B' ' 27' ' ' LEU . 18.8 mt -64.46 -57.13 10.11 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.524 -0.735 . . . . 0.0 109.496 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 1.127 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.89 -68.78 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.252 -0.905 . . . . 0.0 110.055 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.579 ' OE1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -42.74 -49.82 5.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 109.779 -179.421 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.831 HD23 ' CE2' ' B' ' 76' ' ' PHE . 14.1 tp -49.12 -47.54 45.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.004 -1.06 . . . . 0.0 109.555 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.961 HD13 HG22 ' B' ' 53' ' ' VAL . 2.9 mt -63.84 -32.66 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' GLU . 66.3 m-20 -94.46 -77.33 0.46 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.05 . . . . 0.0 109.731 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.418 ' C ' ' O ' ' B' ' 37' ' ' ASN . 5.0 t-20 -42.68 -26.42 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.329 -0.857 . . . . 0.0 109.902 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.713 ' HG2' HD13 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -109.31 -46.24 3.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.084 -1.01 . . . . 0.0 109.922 -179.692 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.724 HD23 ' CD1' ' B' ' 44' ' ' LEU . 0.7 OUTLIER -104.89 61.65 0.7 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.065 -1.022 . . . . 0.0 109.503 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.2 30.01 7.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.59 ' CD2' ' HG3' ' A' ' 4' ' ' GLU . 86.4 m-70 -109.82 -72.03 0.74 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.458 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.47 ' O ' ' CG ' ' B' ' 43' ' ' PHE . 68.6 t80 -86.11 -5.83 59.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.198 -0.939 . . . . 0.0 109.583 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.724 ' CD1' HD23 ' B' ' 40' ' ' LEU . 5.8 mp -102.17 92.91 4.95 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.27 -0.894 . . . . 0.0 109.441 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -57.0 89.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.224 -0.923 . . . . 0.0 109.463 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER 45.4 -170.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.183 -0.948 . . . . 0.0 109.406 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 1.001 HD13 HG21 ' B' ' 53' ' ' VAL . 29.7 mt -98.43 -19.04 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.215 -0.928 . . . . 0.0 109.443 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 83.1 -42.73 0.1 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.686 -0.634 . . . . 0.0 109.725 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.0 OUTLIER 179.55 -44.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.139 -0.976 . . . . 0.0 109.203 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.6 OUTLIER 162.36 58.52 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.362 -0.836 . . . . 0.0 109.243 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -90.42 -70.35 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.201 -0.937 . . . . 0.0 109.899 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.816 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.7 t -87.64 -20.89 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.094 -1.004 . . . . 0.0 109.601 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.127 HG11 ' CD ' ' B' ' 33' ' ' LYS . 54.7 t -76.9 -29.59 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.955 -1.091 . . . . 0.0 109.224 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.3 OUTLIER -90.11 -29.55 18.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.259 -0.901 . . . . 0.0 109.546 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -35.18 35.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.632 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 52' ' ' VAL . 11.1 m -58.63 -47.08 89.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 O-C-N 121.13 -0.981 . . . . 0.0 109.919 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' B' ' 57' ' ' MET . 8.2 tpp -42.01 -28.33 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.014 -1.054 . . . . 0.0 109.14 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 1.7 mp0 -80.71 -45.39 17.19 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.457 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.6 m -73.53 -67.21 0.61 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.405 -0.809 . . . . 0.0 109.39 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.973 HD22 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mt -40.61 -33.87 0.31 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.481 -0.762 . . . . 0.0 109.341 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 57' ' ' MET . 4.7 t0 -90.17 83.95 6.06 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.419 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -96.1 26.92 3.9 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.266 -0.896 . . . . 0.0 109.577 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.448 ' OD2' ' OD2' ' B' ' 69' ' ' ASP . 13.1 m-20 -127.93 -34.17 2.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 109.5 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.15 91.47 1.34 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 177.04 -32.71 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.219 -1.165 . . . . 0.0 108.669 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.13 26.49 4.9 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' B' ' 26' ' ' LYS . 23.8 pt-20 -136.43 124.46 22.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.236 -1.155 . . . . 0.0 109.374 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.57 166.05 19.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.188 -0.945 . . . . 0.0 110.009 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.6 OUTLIER -129.21 172.23 11.66 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.549 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -61.27 -52.66 63.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.489 -179.555 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.439 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.0 pt20 -56.34 -34.77 66.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.133 -0.98 . . . . 0.0 109.225 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.535 ' CA ' ' OE1' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -81.49 -20.2 40.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 108.877 179.561 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.613 ' CE1' HG12 ' B' ' 13' ' ' VAL . 3.9 t80 -65.7 -51.04 62.53 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.881 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -69.11 -46.15 68.41 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.279 -0.888 . . . . 0.0 108.902 179.503 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.975 ' HB2' ' CB ' ' A' ' 75' ' ' ALA . . . -64.74 -18.13 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.171 -0.956 . . . . 0.0 108.87 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.973 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -72.62 -62.78 1.33 Allowed 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.662 ' O ' HG23 ' B' ' 81' ' ' THR . 96.1 t -60.56 -27.58 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.899 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -69.26 -30.58 68.73 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.584 -0.697 . . . . 0.0 109.229 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.71 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 2.4 mmm -76.28 -71.05 0.41 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.17 -0.956 . . . . 0.0 108.643 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.753 HG11 HG12 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -44.6 -24.99 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 O-C-N 120.66 -1.275 . . . . 0.0 109.467 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.662 HG23 ' O ' ' B' ' 77' ' ' VAL . 4.9 p -75.38 -69.61 0.47 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 0.0 108.547 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.2 m -78.01 -53.6 7.24 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -35.96 -37.04 0.1 Allowed 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.257 0.551 . . . . 0.0 109.851 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' B' ' 82' ' ' THR . 5.2 t -88.2 -38.68 15.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.272 -0.892 . . . . 0.0 109.533 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' B' ' 82' ' ' THR . 3.2 t-160 -55.41 -21.23 14.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.479 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -87.59 -37.93 16.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.923 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.0 -20.29 3.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.47 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.15 -69.88 0.1 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.221 -0.924 . . . . 0.0 109.41 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.84 122.97 10.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.279 -0.888 . . . . 0.0 109.456 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -171.69 1.89 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 109.485 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.478 ' OXT' ' CG ' ' B' ' 91' ' ' GLU . 1.5 pt-20 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.468 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.43 ' HB3' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.95 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 1.9 mp0 -67.17 -73.01 0.15 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.216 -0.927 . . . . 0.0 109.455 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.672 HD21 HD23 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.52 -29.73 0.77 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.48 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 1' ' ' SER . 1.0 OUTLIER -65.72 -52.84 48.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.217 -0.927 . . . . 0.0 109.654 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -62.21 -26.1 68.17 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.209 -0.932 . . . . 0.0 109.494 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HB2' ' B' ' 6' ' ' ALA . . . -72.94 -24.41 60.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.515 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' B' ' 81' ' ' THR . 6.8 tpt -80.86 -55.84 4.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.434 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.9 p -60.97 -24.39 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.195 -0.941 . . . . 0.0 109.614 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.756 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -77.43 -66.64 0.81 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.558 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.872 HD13 HD22 ' B' ' 3' ' ' LEU . 4.1 mm? -43.82 -50.37 7.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.687 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.588 HG23 ' N ' ' A' ' 12' ' ' ASP . 17.9 tt -57.61 -45.61 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 109.604 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.588 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.07 -25.72 59.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.27 -0.894 . . . . 0.0 109.865 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.068 ' CG1' HD11 ' A' ' 35' ' ' LEU . 2.7 t -87.08 -28.15 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.1 -1.0 . . . . 0.0 109.725 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 7.1 t80 -66.3 -50.18 64.52 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.919 -1.113 . . . . 0.0 109.389 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -79.33 -31.99 43.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.25 -0.906 . . . . 0.0 109.684 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.4 tt0 -66.22 -65.59 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 109.544 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.559 ' CD1' HG13 ' A' ' 13' ' ' VAL . 19.7 m-85 -56.9 -45.0 82.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.31 -0.869 . . . . 0.0 109.604 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 18.1 m -67.8 -20.55 65.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.179 -0.951 . . . . 0.0 109.56 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.85 -7.79 76.19 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.438 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 23.8 mtp180 -70.68 -64.47 0.89 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -1.146 . . . . 0.0 109.482 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.37 170.05 11.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.278 -0.889 . . . . 0.0 109.438 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . -62.03 88.05 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER 162.07 89.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.379 -1.071 . . . . 0.0 109.307 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.42 35.14 0.76 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.259 -0.901 . . . . 0.0 109.672 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -151.13 16.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.191 -0.943 . . . . 0.0 109.682 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -170.31 168.25 8.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.124 -0.985 . . . . 0.0 109.579 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.884 HD22 ' HB3' ' A' ' 31' ' ' GLU . 89.2 mt -120.0 149.99 41.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.437 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.1 OUTLIER -105.33 94.27 5.13 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 -179.76 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HA ' ' SD ' ' A' ' 57' ' ' MET . 2.0 ttmt 37.01 -84.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.703 -0.623 . . . . 0.0 111.276 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.613 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.8 m -45.18 -46.96 12.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.916 -1.115 . . . . 0.0 109.919 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.884 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -45.38 -46.9 13.45 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.036 -1.04 . . . . 0.0 109.32 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.018 ' CD2' HD22 ' A' ' 60' ' ' LEU . 2.5 mp -60.81 -60.95 2.98 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.592 -0.692 . . . . 0.0 109.247 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.945 ' CD ' HG11 ' A' ' 53' ' ' VAL . 1.2 mmmm -38.93 -36.43 0.28 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.508 -0.745 . . . . 0.0 109.748 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -68.44 -61.49 1.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.111 -0.993 . . . . 0.0 109.255 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.068 HD11 ' CG1' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -41.41 -51.52 3.73 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.697 . . . . 0.0 109.882 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.051 HD13 HG22 ' A' ' 53' ' ' VAL . 53.9 mt -60.61 -50.94 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 110.435 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.75 12.04 4.3 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.972 -1.08 . . . . 0.0 109.955 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.46 ' O ' ' OE1' ' A' ' 39' ' ' GLU . 1.4 t-20 -140.83 12.17 2.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.776 ' CB ' HD12 ' B' ' 3' ' ' LEU . 6.8 mm-40 -151.55 -35.7 0.13 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.007 -1.058 . . . . 0.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.042 HD23 ' HA ' ' A' ' 36' ' ' ILE . 2.1 mm? -44.22 -74.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.018 -1.051 . . . . 0.0 109.432 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.576 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 2.1 p 156.02 -86.35 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.419 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -153.12 -39.15 0.1 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.484 -0.76 . . . . 0.0 109.081 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.486 ' HB2' HD23 ' A' ' 44' ' ' LEU . 85.8 m-85 -43.68 -34.47 1.49 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.344 -0.847 . . . . 0.0 109.358 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.957 HD13 HG12 ' A' ' 80' ' ' VAL . 0.5 OUTLIER -147.21 83.01 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.684 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.516 ' O ' ' CB ' ' A' ' 46' ' ' GLU . 3.1 pp20? -117.83 136.6 53.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.352 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' CB ' ' O ' ' A' ' 45' ' ' GLU . 15.0 tt0 77.99 -3.98 2.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.344 -0.848 . . . . 0.0 109.691 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.92 HG13 HG21 ' A' ' 53' ' ' VAL . 3.3 mm 51.61 101.36 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.272 -0.892 . . . . 0.0 109.683 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -44.12 -33.27 1.44 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.501 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' A' ' 50' ' ' GLN . 15.7 tt0 -179.85 68.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.522 ' HA ' HG21 ' A' ' 47' ' ' ILE . 2.9 mt-30 43.85 56.51 4.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.506 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.14 -69.98 0.69 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.244 -0.91 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.865 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.9 t -89.24 -12.35 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.188 -0.945 . . . . 0.0 109.534 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.051 HG22 HD13 ' A' ' 36' ' ' ILE . 95.0 t -82.52 -26.26 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.123 -0.985 . . . . 0.0 109.17 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -87.49 -36.55 17.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.136 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.88 -47.29 15.33 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.378 -0.826 . . . . 0.0 109.209 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.859 ' O ' HD12 ' A' ' 60' ' ' LEU . 1.5 p -62.96 -43.41 99.0 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 O-C-N 121.194 -0.941 . . . . 0.0 109.253 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.502 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -46.09 -42.36 13.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.45 179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -57.62 12.15 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 56' ' ' VAL . 6.0 t -63.6 -12.91 37.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.231 -0.918 . . . . 0.0 109.616 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.018 HD22 ' CD2' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -79.77 -30.04 40.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -0.858 . . . . 0.0 109.452 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 61' ' ' ASP . 0.5 OUTLIER -89.92 104.73 17.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -99.94 1.14 42.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.286 -0.884 . . . . 0.0 109.585 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.91 -22.49 6.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.933 . . . . 0.0 109.527 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 85.78 99.21 0.74 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER 167.34 -27.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.272 -1.134 . . . . 0.0 108.622 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.42 -14.59 30.28 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.402 ' OE2' ' N ' ' A' ' 67' ' ' GLU . 2.7 mm-40 -79.61 111.42 15.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -1.097 . . . . 0.0 109.31 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.4 t -69.68 156.55 38.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.88 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.508 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -118.57 171.83 7.91 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.418 -0.801 . . . . 0.0 108.843 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -62.63 -51.54 66.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.17 -0.956 . . . . 0.0 110.194 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.451 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.7 mt-30 -56.03 -33.1 64.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 0.0 109.062 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 1.1 mm-40 -81.79 -22.12 37.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.388 -0.82 . . . . 0.0 109.02 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.448 ' CE2' HD12 ' A' ' 10' ' ' LEU . 37.9 t80 -66.78 -58.03 5.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.393 -0.817 . . . . 0.0 109.1 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . 1.045 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 4.1 tpt -64.35 -47.96 77.35 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 109.153 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.834 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -57.05 -29.48 63.46 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.157 -0.964 . . . . 0.0 108.686 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.791 ' CD2' HG23 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -62.0 -66.19 0.58 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.488 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.791 HG23 ' CD2' ' A' ' 76' ' ' PHE . 55.1 t -55.52 -22.2 11.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -59.79 -49.16 78.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.513 -0.742 . . . . 0.0 109.154 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 20.3 mtp -76.64 -65.67 0.91 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.84 0.829 . . . . 0.0 109.664 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.957 HG12 HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -47.64 -21.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 120.449 -1.407 . . . . 0.0 110.108 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 21.9 m -83.49 -63.56 1.33 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 0.0 108.612 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.586 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.3 m -79.62 -53.13 7.14 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.26 -33.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.2 0.524 . . . . 0.0 109.946 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.6 t -89.54 -41.96 11.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.476 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.429 ' N ' ' O ' ' A' ' 82' ' ' THR . 13.8 m170 -50.88 -56.44 12.27 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 109.47 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 1.4 tt0 -67.36 -19.47 65.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 36.7 t80 -46.09 -48.69 17.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.267 -0.895 . . . . 0.0 109.476 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.446 ' O ' ' O ' ' A' ' 89' ' ' GLU . 1.2 m-85 -48.94 -48.23 42.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.923 . . . . 0.0 109.468 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mm-40 60.55 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 109.437 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.5 ' N ' ' ND1' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -51.74 93.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.239 -0.913 . . . . 0.0 109.433 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 89' ' ' GLU . 2.9 tt0 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.985 -1.007 . . . . 0.0 109.5 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.485 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 20.4 m . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.756 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 3.8 mm-40 -73.08 -55.12 6.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 109.257 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.876 HD11 HD21 ' A' ' 35' ' ' LEU . 2.8 mt -76.51 -11.52 59.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.847 . . . . 0.0 109.418 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 7' ' ' MET . 0.1 OUTLIER -74.61 -54.57 7.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.192 -0.942 . . . . 0.0 108.815 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -20.01 58.79 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.303 -0.873 . . . . 0.0 109.068 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.65 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -81.96 -30.47 31.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.388 -0.82 . . . . 0.0 109.568 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' B' ' 4' ' ' GLU . 1.3 ppp? -80.32 -32.01 38.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.133 -0.979 . . . . 0.0 109.392 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.428 ' N ' ' HG3' ' B' ' 7' ' ' MET . 55.4 t -73.09 -49.13 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.127 -0.983 . . . . 0.0 109.17 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.95 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -69.11 -43.91 73.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.346 -0.846 . . . . 0.0 109.613 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 3' ' ' LEU . 50.0 mt -61.96 -28.3 69.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.209 -0.932 . . . . 0.0 109.802 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.958 HD13 ' CE2' ' B' ' 70' ' ' PHE . 5.2 mm -72.16 -43.45 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.374 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 1.3 t70 -67.8 -36.9 81.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.293 -0.88 . . . . 0.0 110.161 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.901 HG13 ' O ' ' B' ' 9' ' ' ALA . 1.3 m -75.03 -34.48 32.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.046 -1.034 . . . . 0.0 110.083 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 69.5 t80 -61.76 -52.23 65.07 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.685 -1.26 . . . . 0.0 109.234 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.429 ' O ' ' C ' ' B' ' 16' ' ' GLN . 29.1 m80 -74.71 -60.46 2.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.25 -0.906 . . . . 0.0 109.755 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 2.3 tt0 -42.73 -47.21 5.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.287 -0.883 . . . . 0.0 109.684 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.735 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.0 m-85 -58.29 -52.16 66.74 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.207 -0.933 . . . . 0.0 109.056 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' B' ' 26' ' ' LYS . 12.2 m -51.86 -27.06 11.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.439 -0.788 . . . . 0.0 109.551 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . -66.95 -41.51 93.26 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 1.3 mmt180 -43.66 -48.51 7.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -1.128 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' B' ' 20' ' ' ARG . 22.0 mt-10 -162.78 148.3 12.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.278 -0.889 . . . . 0.0 109.439 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 87.87 75.98 1.28 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' B' ' 22' ' ' GLY . 2.2 m-20 43.74 -148.8 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.177 -1.19 . . . . 0.0 109.523 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -144.5 68.8 1.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.432 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.3 -38.56 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.918 . . . . 0.0 109.471 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -113.15 169.88 8.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.917 . . . . 0.0 109.401 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 31' ' ' GLU . 12.8 mt -93.97 138.73 31.76 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -0.96 . . . . 0.0 109.612 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.554 ' O ' ' CG ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER -94.46 82.65 4.05 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.382 -0.824 . . . . 0.0 109.504 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.543 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 6.8 ttmt 44.43 -91.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.113 -0.992 . . . . 0.0 110.196 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 28' ' ' LYS . 45.0 m -43.22 -36.88 1.92 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.872 -1.143 . . . . 0.0 110.071 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 27' ' ' LEU . 1.4 mp0 -43.04 -51.43 5.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.084 -1.01 . . . . 0.0 110.352 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.997 HD13 HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -74.63 -35.67 62.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.19 -0.944 . . . . 0.0 109.068 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.542 ' HD3' HG11 ' B' ' 53' ' ' VAL . 1.5 ttpt -52.15 -27.67 15.17 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.054 -1.029 . . . . 0.0 108.741 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.512 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -83.32 -52.34 6.64 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.297 -0.877 . . . . 0.0 108.828 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.882 HD22 ' CE1' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -43.12 -38.96 2.6 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.438 -0.789 . . . . 0.0 108.98 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.863 HG23 HD22 ' B' ' 44' ' ' LEU . 3.8 mt -78.8 -39.1 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 O-C-N 121.561 -0.712 . . . . 0.0 109.318 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -75.94 -0.25 20.81 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.505 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.26 -53.08 3.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.161 -0.962 . . . . 0.0 109.069 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.511 ' HG2' HD22 ' A' ' 3' ' ' LEU . 1.0 OUTLIER -105.31 -28.48 10.88 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.001 179.609 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.871 ' HB3' HD13 ' B' ' 44' ' ' LEU . 74.3 mt -98.02 56.32 1.22 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.406 -0.809 . . . . 0.0 109.37 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 11.5 m -113.16 -4.39 13.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -81.64 -90.77 0.07 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.146 -0.971 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -72.6 -3.82 27.09 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.933 HD23 HD11 ' B' ' 47' ' ' ILE . 0.1 OUTLIER -98.81 64.05 1.44 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.261 -0.9 . . . . 0.0 109.586 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -101.01 174.52 5.97 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.199 -0.938 . . . . 0.0 109.431 179.938 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' B' ' 45' ' ' GLU . 1.1 tt0 77.76 -3.45 2.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.345 -0.847 . . . . 0.0 109.755 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.933 HD11 HD23 ' B' ' 44' ' ' LEU . 4.8 mt -71.36 -6.56 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.104 -0.997 . . . . 0.0 109.444 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -76.77 3.28 12.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.132 -0.98 . . . . 0.0 109.52 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.49 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 1.2 mm-40 -123.54 14.66 9.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.209 -0.932 . . . . 0.0 108.98 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.524 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 75.04 54.21 0.07 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.397 -0.814 . . . . 0.0 109.546 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.4 ' OE1' ' HB3' ' B' ' 46' ' ' GLU . 0.7 OUTLIER -90.08 -70.8 0.65 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.192 -0.943 . . . . 0.0 109.502 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.915 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -93.87 -24.31 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.108 -0.995 . . . . 0.0 108.753 179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.542 HG11 ' HD3' ' B' ' 33' ' ' LYS . 45.8 t -77.22 -17.23 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.356 -0.84 . . . . 0.0 108.869 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.524 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 41.0 t0 -84.18 -46.71 11.6 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.365 -0.835 . . . . 0.0 109.113 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -71.45 -49.8 38.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.236 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.81 HG11 HG22 ' B' ' 80' ' ' VAL . 21.4 m -54.21 -46.74 68.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.134 -0.978 . . . . 0.0 109.352 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 7.4 tpt -43.54 -44.55 6.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 109.719 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -54.43 45.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.209 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.579 HG22 ' O ' ' B' ' 56' ' ' VAL . 4.9 t -71.55 -9.09 57.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 109.542 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.997 HD22 HD13 ' B' ' 32' ' ' LEU . 0.3 OUTLIER -90.88 -10.83 41.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.37 -0.831 . . . . 0.0 109.459 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.14 82.43 6.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 109.294 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -85.01 13.17 6.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -160.76 27.29 0.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.518 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' OD1' ' B' ' 65' ' ' ASP . . . 49.94 68.5 1.37 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' B' ' 64' ' ' GLY . 0.4 OUTLIER -177.06 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.275 -1.133 . . . . 0.0 108.603 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.12 8.25 25.8 Favored Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 1.4 mt-10 -69.91 85.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -1.136 . . . . 0.0 109.455 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' B' ' 60' ' ' LEU . 4.1 m -69.95 140.79 53.07 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -100.67 172.71 6.92 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.958 ' CE2' HD13 ' B' ' 11' ' ' ILE . 0.7 OUTLIER -64.97 -58.83 5.1 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.101 -0.999 . . . . 0.0 110.463 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.81 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.2 OUTLIER -50.92 -49.67 59.14 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.166 -0.959 . . . . 0.0 109.272 -179.511 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.642 ' CB ' ' CZ ' ' B' ' 76' ' ' PHE . 1.3 mm-40 -68.06 -24.56 65.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.382 -0.824 . . . . 0.0 109.021 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.882 ' CE1' HD22 ' B' ' 35' ' ' LEU . 1.7 t80 -66.05 -60.75 2.53 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.479 -0.763 . . . . 0.0 109.606 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.82 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 2.6 mtm -53.55 -34.86 59.77 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.0 109.159 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.834 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -68.86 -34.25 75.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.12 -0.987 . . . . 0.0 108.723 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CZ ' ' CB ' ' B' ' 72' ' ' GLU . 20.4 m-30 -65.31 -66.17 0.58 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.764 HG13 HD11 ' B' ' 40' ' ' LEU . 57.4 t -47.2 -26.72 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 1.045 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -56.95 -64.72 0.78 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 6.0 mtm -56.86 -61.91 2.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.197 -0.939 . . . . 0.0 109.408 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.915 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.35 -22.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 O-C-N 120.66 -1.275 . . . . 0.0 109.528 -179.183 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.533 ' CG2' ' CE ' ' A' ' 7' ' ' MET . 30.2 m -79.0 -69.46 0.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.929 -1.107 . . . . 0.0 109.055 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.3 t -76.41 -48.89 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.142 -0.974 . . . . 0.0 109.073 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.91 -35.16 0.09 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.749 -0.594 . . . . 0.0 110.022 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.536 ' CB ' ' HG ' ' B' ' 44' ' ' LEU . 2.7 t -89.64 -37.49 14.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -0.964 . . . . 0.0 109.712 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 85' ' ' HIS . 1.3 t60 -64.96 -12.12 46.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.205 -0.935 . . . . 0.0 109.551 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.5 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 5.6 pt-20 -90.15 -33.96 16.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 0.0 109.6 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.488 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.5 t80 -68.3 -19.22 64.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.507 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -10.03 59.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -106.33 169.6 8.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.934 . . . . 0.0 109.484 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.26 40.48 0.05 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 109.495 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 118.039 -0.981 . . . . 0.0 109.492 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 49.7 m . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.516 ' HG3' ' CG2' ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.26 -95.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.895 . . . . 0.0 109.66 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.765 HD13 HG21 ' B' ' 13' ' ' VAL . 7.3 mp -47.23 -29.31 2.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.1 -1.0 . . . . 0.0 109.739 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.564 ' OE2' ' CD2' ' B' ' 42' ' ' HIS . 0.5 OUTLIER -52.14 -60.4 3.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.148 -0.97 . . . . 0.0 109.172 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -35.01 79.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.329 -0.857 . . . . 0.0 109.018 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.887 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -69.87 -10.76 59.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.88 -47.61 7.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.303 -0.873 . . . . 0.0 109.196 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.439 ' O ' HG22 ' A' ' 11' ' ' ILE . 52.4 t -64.68 -27.16 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.304 -0.873 . . . . 0.0 109.233 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.625 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -85.54 -58.29 2.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.341 -0.849 . . . . 0.0 109.366 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.8 mt -49.14 -34.28 13.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 0.0 109.337 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.602 HG23 ' N ' ' A' ' 12' ' ' ASP . 3.3 tt -76.21 -46.06 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 109.53 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -55.12 -21.32 12.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.331 -0.855 . . . . 0.0 109.552 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.661 HG22 ' HE2' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.13 -39.63 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.141 -0.974 . . . . 0.0 109.674 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 25.3 t80 -53.73 -41.92 67.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.819 -1.175 . . . . 0.0 108.858 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -79.25 -44.43 21.78 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.341 -0.849 . . . . 0.0 109.205 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' A' ' 15' ' ' HIS . 1.7 tt0 -44.4 -38.93 4.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.268 -0.895 . . . . 0.0 108.82 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.79 ' CE2' HD21 ' A' ' 35' ' ' LEU . 80.8 m-85 -94.08 -78.04 0.44 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.525 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 24.4 p 39.05 28.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.594 -0.691 . . . . 0.0 110.006 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' TYR . . . 76.9 51.82 6.12 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 17' ' ' TYR . 32.7 mtp180 -40.65 -29.52 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.5 -1.0 . . . . 0.0 109.732 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -98.5 85.89 3.47 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.237 -0.915 . . . . 0.0 109.428 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 103.69 91.87 2.22 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 9.8 t70 70.94 154.97 0.14 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.199 -1.177 . . . . 0.0 109.402 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.525 ' CA ' ' OG ' ' A' ' 18' ' ' SER . 10.9 mttp -134.64 60.44 1.7 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.514 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t-80 -130.42 -35.18 1.54 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.21 -0.931 . . . . 0.0 109.558 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.543 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -140.83 167.43 22.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.4 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD12 ' CD2' ' A' ' 32' ' ' LEU . 9.0 mt -88.92 170.06 11.03 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.138 -0.976 . . . . 0.0 109.719 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 2.6 ptmm? -138.92 71.12 1.38 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.375 -0.828 . . . . 0.0 109.238 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 64.9 -83.08 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.581 -0.699 . . . . 0.0 110.225 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 91.0 p -41.98 -55.57 3.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.559 ' OE1' ' CD1' ' A' ' 17' ' ' TYR . 2.8 mm-40 -45.92 -45.82 15.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.028 . . . . 0.0 108.717 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.81 HD12 ' SD ' ' A' ' 57' ' ' MET . 16.3 mt -52.14 -68.25 0.19 Allowed 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.717 ' HG2' HG11 ' A' ' 53' ' ' VAL . 19.3 mttt -38.27 -31.08 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.558 -0.714 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 31' ' ' GLU . 7.9 mm-40 -67.45 -67.61 0.44 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.085 -1.01 . . . . 0.0 109.169 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.79 HD21 ' CE2' ' A' ' 17' ' ' TYR . 18.6 mt -43.85 -45.69 7.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.337 -0.852 . . . . 0.0 109.461 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.12 HD11 ' CE1' ' A' ' 76' ' ' PHE . 44.7 mm -54.05 -62.0 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.384 -0.822 . . . . 0.0 109.672 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.579 ' HB3' ' CD2' ' A' ' 43' ' ' PHE . 10.8 m120 -83.08 16.7 2.25 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.34 -0.85 . . . . 0.0 110.162 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m120 -142.06 16.94 2.1 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.037 -1.04 . . . . 0.0 109.742 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.952 ' OE2' HG13 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -158.4 -33.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.955 -1.091 . . . . 0.0 110.563 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.849 ' CB ' HD21 ' A' ' 44' ' ' LEU . 2.0 mm? -53.49 -68.94 0.13 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.926 -1.109 . . . . 0.0 109.644 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.499 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER 161.31 -76.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.837 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.708 ' CE1' ' HA ' ' A' ' 44' ' ' LEU . 29.6 p-80 -90.89 22.52 3.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.286 -0.884 . . . . 0.0 108.997 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.579 ' CD2' ' HB3' ' A' ' 37' ' ' ASN . 3.6 m-85 62.57 27.21 16.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.473 -0.767 . . . . 0.0 109.811 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.065 HD23 HG22 ' A' ' 36' ' ' ILE . 1.7 mm? 45.41 25.89 0.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.071 -1.018 . . . . 0.0 109.211 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 2.2 mt-10 70.73 47.89 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.234 -0.916 . . . . 0.0 109.186 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.468 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER 42.74 32.81 0.41 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.359 -0.838 . . . . 0.0 109.427 -179.873 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 1.048 HD13 HG21 ' A' ' 53' ' ' VAL . 1.2 mt 50.12 98.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.276 -0.89 . . . . 0.0 109.119 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 17.1 ptpt -40.1 -35.44 0.39 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.463 -0.773 . . . . 0.0 109.873 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 11.8 pt-20 178.13 -31.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.855 . . . . 0.0 109.435 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.555 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mt-30 165.17 50.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.328 -0.857 . . . . 0.0 109.147 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -90.32 -70.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.895 . . . . 0.0 110.135 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.775 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.7 OUTLIER -86.2 -23.37 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.127 -0.983 . . . . 0.0 109.954 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.048 HG21 HD13 ' A' ' 47' ' ' ILE . 83.7 t -81.69 -32.16 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 120.793 -1.192 . . . . 0.0 109.405 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.555 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -90.58 -28.35 18.52 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.188 -0.945 . . . . 0.0 109.499 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 10.3 tptm -87.34 -42.48 12.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.713 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -73.93 -29.8 26.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.118 -0.989 . . . . 0.0 109.127 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.81 ' SD ' HD12 ' A' ' 32' ' ' LEU . 6.9 tpt -49.42 -39.33 32.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.359 -0.838 . . . . 0.0 109.48 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.33 -48.2 20.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.859 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 3.9 t -66.1 -9.53 31.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.891 HD11 HG13 ' A' ' 56' ' ' VAL . 35.2 mt -82.68 -52.83 6.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 109.347 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.62 ' OD2' ' HE2' ' A' ' 57' ' ' MET . 1.0 OUTLIER -75.76 86.9 2.77 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.49 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.64 25.72 2.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 109.428 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -121.8 -27.76 4.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.46 94.67 1.02 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.7 -31.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.267 -1.137 . . . . 0.0 108.576 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.11 -23.91 19.92 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.543 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 4.8 mm-40 -83.94 136.7 33.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.22 -1.165 . . . . 0.0 109.409 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.529 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.84 170.47 13.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.223 -0.923 . . . . 0.0 109.927 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.4 OUTLIER -136.78 171.4 14.56 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.481 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.5 OUTLIER -61.4 -62.2 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.799 -1.188 . . . . 0.0 110.354 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.697 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 0.9 OUTLIER -47.79 -28.67 2.66 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.034 -1.041 . . . . 0.0 108.918 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.529 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -73.22 -43.13 61.77 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.548 -0.72 . . . . 0.0 109.64 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.608 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 29.2 t80 -56.24 -54.36 46.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.875 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -56.4 -58.19 9.08 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.047 -1.033 . . . . 0.0 109.344 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -57.75 -17.38 15.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.2 -0.938 . . . . 0.0 108.975 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 1.12 ' CE1' HD11 ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.66 -70.43 0.32 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.457 -0.777 . . . . 0.0 109.138 179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.952 HG13 ' OE2' ' A' ' 39' ' ' GLU . 46.5 t -52.23 -29.52 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.427 -0.795 . . . . 0.0 109.188 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.22 -41.95 96.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.28 -0.888 . . . . 0.0 109.709 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.693 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.3 mtm -78.19 -70.42 0.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 109.73 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.898 HG11 HD12 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -43.82 -23.96 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.472 -1.393 . . . . 0.0 109.695 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.586 ' N ' HD11 ' A' ' 40' ' ' LEU . 16.8 m -80.34 -68.13 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.0 108.871 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.2 t -77.51 -49.3 15.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.181 -0.949 . . . . 0.0 108.796 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.05 -43.34 0.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.05 -28.76 18.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.314 -0.866 . . . . 0.0 109.607 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 81' ' ' THR . 16.5 t-160 -69.65 -9.69 55.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.907 . . . . 0.0 109.592 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.423 ' HA ' ' CE1' ' A' ' 88' ' ' PHE . 0.9 OUTLIER -88.44 -10.16 50.08 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.203 -0.936 . . . . 0.0 109.497 -179.832 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 88' ' ' PHE . 0.4 OUTLIER -62.82 -21.93 66.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 0.0 109.547 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.575 ' CG ' ' N ' ' A' ' 89' ' ' GLU . 19.0 p90 -43.61 -45.95 7.0 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' N ' ' CG ' ' A' ' 88' ' ' PHE . 2.3 tt0 43.63 93.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.266 -0.896 . . . . 0.0 109.628 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -144.41 81.39 1.66 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.44 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.532 179.988 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.462 ' HB3' ' HB2' ' B' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.625 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -59.68 -72.53 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.196 -0.94 . . . . 0.0 109.833 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.75 HD22 ' N ' ' B' ' 3' ' ' LEU . 3.6 mm? -73.69 -31.64 63.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.0 109.89 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.462 ' HB2' ' HB3' ' B' ' 1' ' ' SER . 3.3 tt0 -56.97 -58.92 6.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.212 -0.93 . . . . 0.0 109.389 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -64.36 -31.09 72.16 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.86 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -75.97 -14.01 60.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.0 109.507 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.539 ' O ' HD12 ' B' ' 11' ' ' ILE . 2.4 mtp -86.87 -37.75 17.4 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 24.6 t -73.83 -34.64 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -0.907 . . . . 0.0 109.397 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.76 -43.27 37.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.663 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.677 HD13 ' CZ ' ' B' ' 73' ' ' PHE . 3.4 mm? -66.47 -55.46 15.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.539 HD12 ' O ' ' B' ' 7' ' ' MET . 45.0 mt -52.35 -47.8 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -0.858 . . . . 0.0 109.72 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -63.16 -33.74 76.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.607 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.779 ' CG1' HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -73.53 -15.69 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.224 -0.923 . . . . 0.0 109.339 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 13.4 t80 -82.89 -44.98 14.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.965 -1.084 . . . . 0.0 108.981 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.456 ' O ' ' OG ' ' B' ' 18' ' ' SER . 75.1 m-70 -66.24 -31.21 71.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.411 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.492 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 4.2 tt0 -81.04 -50.46 9.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.158 -0.964 . . . . 0.0 109.407 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.861 ' O ' HD22 ' B' ' 27' ' ' LEU . 10.0 m-85 -78.68 4.03 14.8 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.308 -0.87 . . . . 0.0 109.574 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.554 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.1 p -83.36 41.45 0.77 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.194 -0.941 . . . . 0.0 109.76 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . 103.99 55.67 0.77 Allowed Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' B' ' 16' ' ' GLN . 11.9 mtp85 -45.02 -26.39 0.43 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.31 -1.112 . . . . 0.0 109.132 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -132.06 117.22 18.08 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.327 -0.858 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.04 -109.62 3.76 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -63.62 178.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 109.421 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' B' ' 18' ' ' SER . 15.4 ttmm -161.51 56.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.517 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -161.64 -36.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.587 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.482 ' C ' HD23 ' B' ' 27' ' ' LEU . 33.1 mtmt -131.67 170.16 15.16 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.144 -0.972 . . . . 0.0 109.481 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.861 HD22 ' O ' ' B' ' 17' ' ' TYR . 4.0 mt -95.29 142.9 27.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.172 -0.955 . . . . 0.0 109.918 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.523 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 9.4 pttp -124.32 74.29 1.3 Allowed 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.418 -0.801 . . . . 0.0 108.874 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.678 ' HA ' HD12 ' B' ' 32' ' ' LEU . 4.6 tppt? 68.3 -81.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.692 -0.63 . . . . 0.0 110.283 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -49.47 -46.02 47.52 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.083 -1.011 . . . . 0.0 110.406 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' CG ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -58.18 -34.64 70.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.0 -1.062 . . . . 0.0 109.618 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.807 HD23 HD12 ' B' ' 27' ' ' LEU . 12.1 mt -67.98 -69.57 0.31 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.478 -0.763 . . . . 0.0 109.51 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.477 ' HG3' HG11 ' B' ' 53' ' ' VAL . 8.8 mtpt -40.76 -27.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.396 -0.815 . . . . 0.0 110.171 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.498 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.5 OUTLIER -76.91 -58.75 3.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.034 -1.041 . . . . 0.0 109.424 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.807 HD21 ' CE1' ' B' ' 73' ' ' PHE . 23.4 tp -41.37 -47.16 3.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.716 HG23 HD12 ' B' ' 40' ' ' LEU . 1.3 mp -78.16 -38.95 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.0 110.082 -179.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' B' ' 33' ' ' LYS . 4.6 m120 -80.29 4.53 17.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.927 -1.108 . . . . 0.0 110.044 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.465 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 1.0 OUTLIER -126.68 -16.08 5.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.09 -1.006 . . . . 0.0 109.937 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 64.9 mm-40 -123.86 -9.74 7.76 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.109 -0.995 . . . . 0.0 109.633 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.877 ' HB3' HD22 ' B' ' 44' ' ' LEU . 37.0 mt -117.29 67.17 0.74 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.199 -0.938 . . . . 0.0 109.685 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.58 ' O ' ' CG ' ' B' ' 42' ' ' HIS . 0.4 OUTLIER -112.56 46.88 1.14 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.336 -0.852 . . . . 0.0 109.087 179.681 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' B' ' 41' ' ' SER . 93.4 m-70 -160.9 99.71 1.24 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.378 -0.826 . . . . 0.0 108.91 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.531 ' CB ' ' O ' ' B' ' 42' ' ' HIS . 4.0 m-85 81.67 17.3 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.654 -0.654 . . . . 0.0 109.415 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.903 HD21 ' O ' ' B' ' 80' ' ' VAL . 0.1 OUTLIER -123.52 -9.5 7.96 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 44' ' ' LEU . 1.8 mm-40 45.89 -171.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.229 -0.919 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' B' ' 48' ' ' LYS . 4.4 mm-40 -83.01 158.76 22.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.222 -0.924 . . . . 0.0 109.419 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.695 HD12 HG23 ' B' ' 53' ' ' VAL . 24.6 mm -58.53 -24.05 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.172 -0.955 . . . . 0.0 109.431 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 5.8 mttt 83.09 -42.67 0.1 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.692 -0.63 . . . . 0.0 109.713 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.8 OUTLIER 164.52 -25.26 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.097 -1.002 . . . . 0.0 109.368 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.511 ' HB2' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 165.11 51.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.265 -0.897 . . . . 0.0 109.574 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.478 ' OE1' ' HE3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.14 -70.66 0.66 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.135 -0.978 . . . . 0.0 109.558 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.776 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.4 t -90.85 -24.79 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.231 -0.918 . . . . 0.0 108.982 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.695 HG23 HD12 ' B' ' 47' ' ' ILE . 69.7 t -72.39 -22.22 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.283 -0.885 . . . . 0.0 108.928 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.511 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 7.6 t70 -86.91 -53.47 4.88 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.302 -0.874 . . . . 0.0 109.111 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.47 -42.52 78.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.287 -0.883 . . . . 0.0 109.122 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.905 ' HB ' HD13 ' B' ' 60' ' ' LEU . 35.2 m -61.85 -47.36 93.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 O-C-N 121.235 -0.915 . . . . 0.0 109.196 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.606 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.08 -27.62 0.22 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.4 OUTLIER -77.58 -47.44 19.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.336 -0.853 . . . . 0.0 108.699 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.454 ' O ' ' C ' ' B' ' 60' ' ' LEU . 9.2 m -76.26 -66.44 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.378 -0.826 . . . . 0.0 109.095 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.905 HD13 ' HB ' ' B' ' 56' ' ' VAL . 1.5 mp -39.9 -30.16 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.51 -0.744 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' B' ' 59' ' ' THR . 48.9 t0 -90.21 110.68 21.71 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.232 -0.918 . . . . 0.0 109.425 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -141.98 25.5 1.93 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -0.955 . . . . 0.0 109.531 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.62 -15.54 8.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 90.33 55.31 1.97 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 8.0 t70 179.28 -33.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.228 -1.16 . . . . 0.0 108.634 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.428 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.1 34.34 2.37 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.476 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 7.2 mm-40 -104.87 114.44 28.64 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -1.147 . . . . 0.0 109.434 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.555 ' HB2' HD21 ' B' ' 32' ' ' LEU . 12.0 t -70.1 158.31 35.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.278 -0.889 . . . . 0.0 109.617 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -132.05 171.18 13.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.405 -0.809 . . . . 0.0 108.924 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.471 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -53.2 -48.36 68.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.321 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.435 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.0 pt20 -59.27 -36.01 74.75 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.345 -0.847 . . . . 0.0 108.826 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.489 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.6 OUTLIER -82.23 -12.34 58.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.409 -0.807 . . . . 0.0 109.217 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.807 ' CE1' HD21 ' B' ' 35' ' ' LEU . 3.8 t80 -73.11 -57.92 3.68 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.851 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 46.4 mtt -68.31 -44.33 75.66 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.388 -0.82 . . . . 0.0 109.332 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.82 -40.6 89.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -0.876 . . . . 0.0 109.406 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.883 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.2 t80 -57.43 -68.73 0.21 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.271 -0.893 . . . . 0.0 109.131 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.649 HG13 HD21 ' B' ' 40' ' ' LEU . 71.2 t -52.45 -22.69 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -62.07 -50.87 70.25 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.56 -0.713 . . . . 0.0 109.206 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 29.7 mtp -74.01 -66.92 0.66 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.43 -0.794 . . . . 0.0 109.366 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.903 ' O ' HD21 ' B' ' 44' ' ' LEU . 0.1 OUTLIER -42.59 -25.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.502 -1.374 . . . . 0.0 109.631 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.728 ' HA ' HD11 ' B' ' 44' ' ' LEU . 5.9 m -78.63 -70.01 0.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.982 -1.074 . . . . 0.0 108.722 178.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.562 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.1 t -77.82 -49.07 15.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.226 -0.921 . . . . 0.0 108.765 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -39.39 -44.09 1.29 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.684 -0.635 . . . . 0.0 109.543 179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' B' ' 44' ' ' LEU . 46.4 t -73.27 -40.37 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.861 . . . . 0.0 109.478 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.17 -13.49 48.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.22 -0.925 . . . . 0.0 109.398 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -77.23 -40.57 44.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.46 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -30.79 70.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -53.32 -36.0 60.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -105.76 98.95 8.57 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.205 -0.934 . . . . 0.0 109.492 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -166.8 158.3 12.72 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.251 -0.906 . . . . 0.0 109.451 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.475 -179.965 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.467 ' HG2' ' CB ' ' B' ' 9' ' ' ALA . 41.4 tt0 -80.29 -61.75 1.88 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.446 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.971 HD11 HD13 ' B' ' 10' ' ' LEU . 12.1 tp -64.43 -11.09 29.75 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.269 -0.895 . . . . 0.0 109.473 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -89.16 -53.32 4.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.243 -0.911 . . . . 0.0 109.411 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.86 -27.28 63.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.911 . . . . 0.0 109.373 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -70.2 -32.67 70.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.412 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.589 ' HE1' ' HG ' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -71.33 -43.33 67.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.0 t -71.45 -28.4 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.0 109.656 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -78.39 -68.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.927 . . . . 0.0 109.581 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.846 ' CD2' HD13 ' B' ' 3' ' ' LEU . 81.4 mt -43.71 -48.51 7.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.591 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.86 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -58.97 -44.45 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.867 . . . . 0.0 109.633 -179.886 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.54 ' N ' HG23 ' A' ' 11' ' ' ILE . 5.8 t70 -66.65 -19.2 65.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 110.063 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.082 HG11 HD11 ' A' ' 35' ' ' LEU . 2.7 t -88.58 -29.51 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.03 -1.044 . . . . 0.0 109.607 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -71.33 -46.06 61.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.824 -1.172 . . . . 0.0 109.12 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' ' HG2' ' A' ' 24' ' ' LYS . 16.4 t-80 -77.8 -34.71 51.99 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.538 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -68.94 -63.83 0.98 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.919 . . . . 0.0 109.418 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.843 ' CD1' HG13 ' A' ' 13' ' ' VAL . 36.7 m-85 -53.73 -38.52 64.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.251 -0.905 . . . . 0.0 109.435 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 18.7 m -68.39 -30.97 70.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.17 -0.956 . . . . 0.0 109.492 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.462 ' HA2' ' HG3' ' A' ' 24' ' ' LYS . . . -57.22 -19.06 30.6 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.6 mmt180 -72.3 -38.06 68.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.248 -1.148 . . . . 0.0 109.444 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.472 ' OE2' ' HB2' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -78.26 164.15 25.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.242 -0.912 . . . . 0.0 109.491 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -50.51 -51.91 30.65 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.472 ' HB2' ' OE2' ' A' ' 21' ' ' GLU . 42.5 m-20 -78.17 -173.35 3.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -1.169 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HG3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -142.08 56.06 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 109.449 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.506 ' CG ' ' O ' ' A' ' 25' ' ' HIS . 76.0 t60 -169.99 32.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 109.483 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 9.2 ptpt -170.03 170.31 7.61 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.197 -0.94 . . . . 0.0 109.524 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.887 HD22 ' HB3' ' A' ' 31' ' ' GLU . 87.4 mt -134.64 129.96 35.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 109.78 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 1.034 ' O ' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -78.75 166.51 22.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.181 -0.95 . . . . 0.0 108.763 179.266 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.478 ' CG ' ' SD ' ' A' ' 57' ' ' MET . 11.3 mttt -42.65 -27.22 0.16 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 0.0 109.672 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -77.59 -58.38 3.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.968 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.887 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.6 mm-40 -46.76 -42.83 17.5 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.087 -1.008 . . . . 0.0 109.296 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.034 HD12 ' O ' ' A' ' 28' ' ' LYS . 1.7 mp -59.03 -65.87 0.6 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.558 -0.714 . . . . 0.0 109.204 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.701 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -41.58 -32.09 0.33 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.311 -0.868 . . . . 0.0 109.685 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -67.48 -61.73 1.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.212 -0.93 . . . . 0.0 109.468 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.082 HD11 HG11 ' A' ' 13' ' ' VAL . 2.0 mm? -40.92 -51.35 3.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.912 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.929 HG21 HD11 ' A' ' 47' ' ' ILE . 46.6 mt -62.07 -44.17 98.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 110.025 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HG12 ' A' ' 47' ' ' ILE . 72.7 m-20 -88.13 9.93 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.0 109.954 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 1.7 t-20 -105.62 -26.39 11.87 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.118 -0.989 . . . . 0.0 109.085 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.986 ' OE2' HD13 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -134.88 -35.3 0.87 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.405 -0.809 . . . . 0.0 109.547 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.685 HD12 ' N ' ' A' ' 40' ' ' LEU . 7.8 mp -86.32 15.1 5.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.569 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.36 -9.04 29.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -122.65 -10.34 8.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -91.21 -39.51 12.06 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.263 -0.898 . . . . 0.0 109.489 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.846 HD23 ' O ' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -123.97 32.89 5.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.31 -0.869 . . . . 0.0 109.448 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.427 ' O ' ' C ' ' A' ' 46' ' ' GLU . 1.5 mt-10 43.8 71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.251 -0.906 . . . . 0.0 109.543 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.521 ' O ' HD13 ' A' ' 44' ' ' LEU . 14.3 mm-40 43.74 -151.65 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.295 -0.878 . . . . 0.0 109.571 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.929 HD11 HG21 ' A' ' 36' ' ' ILE . 34.8 mm -121.96 -58.45 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.311 -0.868 . . . . 0.0 109.606 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.505 ' CG ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 43.81 -81.99 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.933 0.873 . . . . 0.0 110.478 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 47' ' ' ILE . 13.4 mm-40 -46.02 -33.55 3.47 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.523 ' HA ' ' CG2' ' A' ' 47' ' ' ILE . 1.3 tt0 76.4 32.88 0.56 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 109.351 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 55' ' ' LYS . 3.3 mm-40 -72.69 -49.49 31.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.529 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.814 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.3 OUTLIER -91.52 -18.16 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.197 -0.939 . . . . 0.0 109.37 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.777 ' CG2' HG21 ' A' ' 47' ' ' ILE . 25.1 t -82.0 -37.84 15.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 120.793 -1.192 . . . . 0.0 109.022 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.09 -29.66 17.18 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.983 -1.073 . . . . 0.0 109.3 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 25.1 tttm -90.91 -35.51 14.69 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.321 -0.862 . . . . 0.0 110.559 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.716 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -90.52 -25.64 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 120.846 -1.159 . . . . 0.0 110.361 -178.924 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.838 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -71.96 -49.62 35.78 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.848 -1.157 . . . . 0.0 109.22 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -35.84 74.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.12 -0.988 . . . . 0.0 108.82 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 5.6 t -90.31 -9.83 46.35 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.443 -0.785 . . . . 0.0 109.422 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -65.89 -45.96 80.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.368 -0.833 . . . . 0.0 109.448 -179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.429 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 9.0 m-20 -61.34 88.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.42 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -71.63 -10.27 59.52 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 0.0 109.504 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.78 -37.29 10.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.516 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 97.78 93.37 1.93 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 39.1 t0 178.61 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.269 -1.136 . . . . 0.0 108.658 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 110.18 19.08 8.24 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 26' ' ' LYS . 53.5 mt-10 -127.15 129.25 47.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -1.137 . . . . 0.0 109.47 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 8.6 t -69.74 155.54 40.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.639 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.503 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -126.17 171.44 10.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -61.47 -50.46 72.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.124 -0.985 . . . . 0.0 110.501 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' HG2' ' B' ' 79' ' ' MET . 2.8 pt20 -58.4 -40.09 81.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.947 . . . . 0.0 108.836 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.521 ' HG3' HD23 ' A' ' 60' ' ' LEU . 1.1 tt0 -80.6 -12.24 59.54 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.477 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 19.3 t80 -69.94 -51.99 28.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.197 -0.94 . . . . 0.0 108.503 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.833 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 26.9 mtt -68.98 -43.47 74.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.957 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -67.33 -20.32 65.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 108.652 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.704 ' HE1' HD11 ' A' ' 36' ' ' ILE . 1.1 t80 -68.13 -57.95 5.24 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.651 HG21 HD12 ' B' ' 3' ' ' LEU . 55.0 t -66.86 -25.87 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 121.334 -0.854 . . . . 0.0 108.758 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -68.51 -27.27 65.97 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.429 -0.795 . . . . 0.0 109.065 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.66 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 11.6 mtm -84.2 -70.09 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 108.971 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.846 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -45.65 -23.02 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 O-C-N 120.302 -1.498 . . . . 0.0 109.892 -179.658 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.564 HG23 ' N ' ' A' ' 82' ' ' THR . 4.0 t -85.25 -52.26 6.03 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.747 -1.221 . . . . 0.0 109.327 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.619 HG21 ' HB3' ' B' ' 70' ' ' PHE . 1.1 t -90.82 -51.31 5.43 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.705 -1.221 . . . . 0.0 107.705 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.02 -42.06 0.39 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.369 0.604 . . . . 0.0 109.628 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.42 -37.02 23.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.289 -0.882 . . . . 0.0 109.428 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.422 ' N ' ' O ' ' A' ' 82' ' ' THR . 2.8 t-160 -60.19 -16.15 30.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 89' ' ' GLU . 79.8 mm-40 -85.89 -38.36 18.14 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.219 -0.926 . . . . 0.0 109.43 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.11 -52.02 67.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 0.0 109.451 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -69.06 -68.85 0.37 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.318 -0.864 . . . . 0.0 109.459 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -73.45 136.64 44.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.458 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -132.01 142.92 49.74 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.211 -0.931 . . . . 0.0 109.483 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.429 -179.979 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.504 ' HG3' ' CG2' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -45.52 -71.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.255 -0.903 . . . . 0.0 109.622 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 1.005 ' CD2' HG21 ' A' ' 13' ' ' VAL . 4.0 mm? -57.6 -20.22 31.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.278 -0.889 . . . . 0.0 109.816 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -62.58 -62.38 1.78 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.196 -0.94 . . . . 0.0 109.521 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -59.39 -40.38 86.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.272 -0.892 . . . . 0.0 109.661 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -68.45 -20.23 64.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.196 -0.94 . . . . 0.0 109.566 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.647 ' O ' HD12 ' B' ' 11' ' ' ILE . 0.0 OUTLIER -74.98 -59.37 2.77 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.548 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.663 HG12 ' OD2' ' B' ' 12' ' ' ASP . 3.4 t -76.52 -11.39 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 109.473 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.696 ' O ' HG13 ' B' ' 13' ' ' VAL . . . -81.85 -68.41 0.7 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.265 -0.897 . . . . 0.0 109.533 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.971 HD13 HD11 ' A' ' 3' ' ' LEU . 3.5 mm? -62.23 -30.09 70.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.431 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.647 HD12 ' O ' ' B' ' 7' ' ' MET . 74.2 mt -69.85 -47.55 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.903 -1.123 . . . . 0.0 108.785 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.663 ' OD2' HG12 ' B' ' 8' ' ' VAL . 0.5 OUTLIER -53.62 -37.86 63.47 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.94 HG11 HD13 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -72.99 -40.41 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 O-C-N 121.136 -0.978 . . . . 0.0 109.495 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 5.9 t80 -45.61 -47.21 14.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.836 -1.165 . . . . 0.0 108.224 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -80.3 -26.93 38.62 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.436 -0.79 . . . . 0.0 109.551 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -68.06 -70.15 0.28 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.995 . . . . 0.0 108.915 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 1.0 ' CD2' HD22 ' B' ' 35' ' ' LEU . 40.3 m-85 -49.71 -48.79 49.66 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.333 -0.854 . . . . 0.0 109.319 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 81.2 p -56.33 -35.35 67.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 109.716 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.455 ' HA2' ' HG2' ' B' ' 24' ' ' LYS . . . -66.58 -36.25 91.12 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 2.5 mmt180 -44.01 -28.29 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.276 -1.131 . . . . 0.0 109.513 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.475 ' HB3' ' HE3' ' B' ' 28' ' ' LYS . 5.9 mm-40 -126.64 156.11 41.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.452 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.43 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . -44.03 161.49 0.07 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.441 ' HB2' ' NZ ' ' B' ' 26' ' ' LYS . 25.6 m-20 55.18 100.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.266 -1.138 . . . . 0.0 109.447 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.455 ' HG2' ' HA2' ' B' ' 19' ' ' GLY . 15.0 mtmt -99.34 64.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.472 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.86 8.32 2.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.221 -0.925 . . . . 0.0 109.647 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.11 170.19 7.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.173 -0.955 . . . . 0.0 109.591 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' B' ' 31' ' ' GLU . 15.5 mt -107.63 148.84 28.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 21' ' ' GLU . 1.9 ptpt -124.74 85.47 2.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.692 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.501 ' HG2' ' N ' ' B' ' 30' ' ' SER . 24.5 ttmt 59.66 -86.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.371 -0.831 . . . . 0.0 110.231 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.501 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 10.1 m -42.97 -56.37 3.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 0.0 110.184 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.3 mp0 -47.49 -42.15 22.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.057 -1.027 . . . . 0.0 109.538 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.641 HD21 ' HB2' ' B' ' 27' ' ' LEU . 26.6 mt -55.39 -61.79 2.11 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.598 -0.689 . . . . 0.0 109.476 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.756 ' HE2' HG11 ' B' ' 53' ' ' VAL . 6.0 ttmt -47.89 -70.19 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.272 -0.893 . . . . 0.0 109.705 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.476 ' OE2' ' HA ' ' B' ' 31' ' ' GLU . 18.8 pt-20 -44.07 -28.76 0.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.16 -0.962 . . . . 0.0 109.463 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 1.0 HD22 ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -58.75 -57.74 11.66 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.848 . . . . 0.0 109.479 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.888 HG23 HD22 ' B' ' 40' ' ' LEU . 2.6 mp -74.07 -55.11 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.687 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.422 ' C ' ' O ' ' B' ' 36' ' ' ILE . 4.9 m120 -41.75 -27.6 0.12 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.308 -0.87 . . . . 0.0 109.771 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.524 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 3.1 m-20 -90.79 -45.65 8.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.189 -0.944 . . . . 0.0 109.549 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CG1' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -73.25 -65.65 0.78 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.165 -0.959 . . . . 0.0 109.511 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.888 HD22 HG23 ' B' ' 36' ' ' ILE . 8.5 mp -62.88 -49.71 73.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.257 -0.902 . . . . 0.0 109.48 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.515 ' O ' ' CB ' ' B' ' 42' ' ' HIS . 0.1 OUTLIER 57.2 70.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.203 -0.936 . . . . 0.0 109.376 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.515 ' CB ' ' O ' ' B' ' 41' ' ' SER . 0.7 OUTLIER 76.47 -0.97 2.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.322 -0.861 . . . . 0.0 109.593 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.488 ' HB2' ' CA ' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -65.77 -12.45 54.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 109.427 179.928 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.885 HD23 ' H ' ' B' ' 44' ' ' LEU . 2.6 pt? -134.88 28.75 3.51 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.265 -0.897 . . . . 0.0 109.401 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' B' ' 46' ' ' GLU . 6.6 tt0 58.38 40.42 24.31 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.334 -0.854 . . . . 0.0 109.511 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.735 ' C ' HD13 ' B' ' 47' ' ' ILE . 0.5 OUTLIER 44.07 -153.02 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.235 -0.916 . . . . 0.0 109.373 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.753 HG21 ' HB ' ' B' ' 53' ' ' VAL . 0.6 OUTLIER -117.84 99.25 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.26 -0.9 . . . . 0.0 109.181 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' B' ' 49' ' ' GLU . 2.8 ptpt -43.41 -26.89 0.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.853 . . . . 0.0 109.528 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.517 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.1 tt0 178.36 -32.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.449 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.53 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 165.09 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.287 -0.883 . . . . 0.0 109.451 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -70.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.18 -0.95 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.905 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -90.18 -24.37 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.206 -0.934 . . . . 0.0 109.238 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.756 HG11 ' HE2' ' B' ' 33' ' ' LYS . 40.0 t -75.97 -29.86 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.219 -0.926 . . . . 0.0 108.885 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.53 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 6.8 t0 -79.82 -39.67 30.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.326 -0.859 . . . . 0.0 108.895 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.543 ' O ' HG23 ' B' ' 59' ' ' THR . 44.3 mmtt -65.54 -51.93 56.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 109.029 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.88 HG22 ' O ' ' B' ' 52' ' ' VAL . 16.5 m -55.8 -45.93 79.73 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 O-C-N 121.287 -0.883 . . . . 0.0 109.641 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.644 ' HE1' ' HA2' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -39.01 -31.66 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.809 -1.182 . . . . 0.0 110.224 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.465 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.1 OUTLIER -90.63 -35.98 14.66 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.142 -0.974 . . . . 0.0 109.361 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.568 ' OG1' HD23 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -73.15 -60.33 2.29 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.387 -0.82 . . . . 0.0 110.031 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.627 ' CD1' ' CG ' ' B' ' 76' ' ' PHE . 2.9 mt -45.33 -44.21 11.45 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.923 . . . . 0.0 109.61 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 19.9 p-10 -89.95 111.53 22.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 109.494 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -98.34 -23.13 15.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.569 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -82.26 -20.01 38.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.552 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.26 94.21 0.61 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 173.11 -30.62 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.259 -1.142 . . . . 0.0 108.599 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.644 ' HA2' ' HE1' ' B' ' 57' ' ' MET . . . 110.29 21.14 7.08 Favored Glycine 0 N--CA 1.485 1.926 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -107.74 99.72 9.17 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.246 -1.149 . . . . 0.0 109.409 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 17.2 t -72.43 157.4 37.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.191 -0.943 . . . . 0.0 109.698 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 1.1 m-20 -117.17 171.58 7.85 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.619 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -59.05 -50.2 74.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.305 -179.715 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.446 ' CG ' ' HG2' ' A' ' 79' ' ' MET . 18.4 mt-30 -55.81 -45.53 78.28 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.27 -0.894 . . . . 0.0 108.944 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.484 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -76.82 -13.29 60.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.408 -0.807 . . . . 0.0 109.395 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.648 ' HE1' HD21 ' B' ' 35' ' ' LEU . 6.5 t80 -70.72 -66.88 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.191 -0.943 . . . . 0.0 108.607 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.893 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 4.1 mtt -58.59 -39.03 79.24 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.341 -0.849 . . . . 0.0 108.884 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.957 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -64.64 -29.8 70.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.294 -0.879 . . . . 0.0 109.059 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.799 ' CE1' HG11 ' B' ' 56' ' ' VAL . 2.0 t80 -64.45 -63.7 1.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.422 -0.798 . . . . 0.0 109.287 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.726 ' CG2' HD12 ' B' ' 35' ' ' LEU . 49.5 t -56.9 -25.71 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.334 -0.854 . . . . 0.0 109.111 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.833 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -66.11 -41.81 90.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.325 -0.859 . . . . 0.0 109.415 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.0 mtm -73.79 -67.1 0.63 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.261 -0.899 . . . . 0.0 109.41 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.905 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.46 -25.04 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 120.637 -1.289 . . . . 0.0 109.247 -179.576 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.567 HG23 ' CE ' ' A' ' 7' ' ' MET . 13.0 m -76.3 -70.05 0.47 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.154 -0.966 . . . . 0.0 108.963 178.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.6 t -77.13 -49.53 15.03 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.171 -0.956 . . . . 0.0 108.922 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.71 -31.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.757 -0.589 . . . . 0.0 109.774 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.477 ' N ' ' O ' ' B' ' 82' ' ' THR . 47.6 t -87.47 -42.25 12.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.317 -0.864 . . . . 0.0 109.535 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.2 OUTLIER -65.69 -9.96 32.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 109.536 -179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.423 ' OE1' ' O ' ' B' ' 91' ' ' GLU . 0.4 OUTLIER -66.18 -17.65 64.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.191 -0.943 . . . . 0.0 109.506 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -73.85 -37.09 64.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -57.59 -69.91 0.15 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.261 -0.9 . . . . 0.0 109.511 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -106.42 149.33 27.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.302 -0.874 . . . . 0.0 109.496 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 61.56 174.75 0.12 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.483 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.423 ' O ' ' OE1' ' B' ' 86' ' ' GLU . 1.2 tp10 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.477 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' GLU . 1.3 m . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.635 ' CG ' HG23 ' B' ' 13' ' ' VAL . 0.5 OUTLIER -73.9 -38.89 64.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.077 HD12 HG21 ' B' ' 77' ' ' VAL . 2.9 mm? -80.33 -34.39 36.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.26 -0.9 . . . . 0.0 109.43 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' A' ' 1' ' ' SER . 25.9 tt0 -60.13 -58.34 8.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -63.11 -38.78 92.53 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.22 -0.925 . . . . 0.0 109.254 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -73.22 -11.87 60.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.254 -0.904 . . . . 0.0 109.399 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -42.84 16.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.41 ' C ' HG22 ' A' ' 11' ' ' ILE . 22.0 t -75.53 -25.87 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.405 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.98 -50.01 9.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.224 -0.923 . . . . 0.0 109.514 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.548 HD12 ' CE2' ' A' ' 73' ' ' PHE . 3.9 mm? -62.52 -33.23 74.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.586 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -73.25 -46.33 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.926 . . . . 0.0 109.468 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.586 ' N ' HG23 ' A' ' 11' ' ' ILE . 9.5 t70 -65.83 -16.94 64.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.292 -0.88 . . . . 0.0 109.414 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.951 HG21 HD13 ' B' ' 3' ' ' LEU . 2.8 t -89.99 -37.3 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 0.0 109.359 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 68.7 t80 -62.83 -43.73 98.02 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.02 -1.05 . . . . 0.0 109.456 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 47.8 m170 -82.19 -49.93 9.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.303 -0.873 . . . . 0.0 109.795 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.2 tt0 -52.1 -59.75 4.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 109.612 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.719 ' CG ' HD21 ' A' ' 35' ' ' LEU . 44.7 m-85 -60.57 -48.71 80.59 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.897 . . . . 0.0 109.675 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 60.1 p -63.04 -11.61 20.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.208 -0.932 . . . . 0.0 109.689 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.521 ' HA2' ' CA ' ' A' ' 24' ' ' LYS . . . -70.69 -37.57 67.23 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 9.9 mmt180 -44.13 -41.63 5.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 8.5 tt0 -76.46 82.91 3.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 0.0 109.447 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.13 -91.15 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 21' ' ' GLU . 12.6 p30 -96.59 158.14 15.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' CA ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -89.63 119.91 30.46 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.31 -0.869 . . . . 0.0 109.449 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -169.58 -49.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -0.947 . . . . 0.0 109.693 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 3.6 mtmt -136.48 170.12 16.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 109.71 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD22 ' HB3' ' A' ' 31' ' ' GLU . 24.2 mt -102.43 150.36 23.44 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.292 -0.88 . . . . 0.0 109.463 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.523 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -115.56 70.05 0.74 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.171 -0.956 . . . . 0.0 109.854 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 63.34 -82.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.552 -0.717 . . . . 0.0 110.792 179.215 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.46 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 t -48.99 -29.09 4.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.034 -1.041 . . . . 0.0 110.32 -179.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.64 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.8 mp0 -66.84 -41.89 86.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.95 -1.094 . . . . 0.0 108.794 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.513 ' CD1' ' HE2' ' A' ' 57' ' ' MET . 14.8 mt -59.71 -61.22 2.78 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.78 ' CE ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -40.49 -45.06 2.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.645 -0.66 . . . . 0.0 109.437 179.627 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.507 ' OE1' ' ND2' ' A' ' 38' ' ' ASN . 0.7 OUTLIER -53.09 -61.32 2.38 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 109.319 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.719 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.2 mm? -54.81 -25.6 29.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.266 -0.896 . . . . 0.0 109.929 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.04 HG21 ' CG2' ' A' ' 53' ' ' VAL . 26.6 mm -64.09 -44.79 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.049 -1.032 . . . . 0.0 109.906 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' CA ' ' HB2' ' A' ' 41' ' ' SER . 9.8 m-20 -82.42 -52.73 6.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.114 -0.991 . . . . 0.0 109.931 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.507 ' ND2' ' OE1' ' A' ' 34' ' ' GLU . 3.7 m-80 -40.52 -52.27 2.83 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.39 -0.818 . . . . 0.0 110.248 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.909 ' OE2' HG22 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -96.28 -26.12 15.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.058 -1.026 . . . . 0.0 109.949 -179.506 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.798 HD21 ' SD ' ' B' ' 7' ' ' MET . 5.7 mt -135.51 67.46 1.48 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.471 ' HB2' ' CA ' ' A' ' 37' ' ' ASN . 11.4 t -100.93 -18.63 16.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.863 . . . . 0.0 109.455 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -112.56 -41.42 3.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.251 -0.906 . . . . 0.0 109.45 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.468 ' C ' HD23 ' A' ' 44' ' ' LEU . 87.8 m-85 -58.69 -27.26 64.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 0.0 109.428 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 40' ' ' LEU . 1.9 mt -94.16 -16.03 24.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 67.69 65.32 0.39 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.523 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 2.2 tp10 64.9 23.42 12.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.285 -0.884 . . . . 0.0 109.405 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.919 HD13 HG21 ' A' ' 53' ' ' VAL . 6.7 mt 79.81 -9.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.559 -0.713 . . . . 0.0 110.072 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 0.6 OUTLIER 83.49 -43.5 0.1 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.509 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.5 mt-10 168.95 36.61 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.135 -0.978 . . . . 0.0 109.311 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 57.85 36.15 26.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 109.34 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -90.15 -37.38 14.23 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.262 -0.899 . . . . 0.0 109.756 -179.804 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.897 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.9 t -98.06 -28.42 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.108 -0.995 . . . . 0.0 109.83 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.04 ' CG2' HG21 ' A' ' 36' ' ' ILE . 25.3 t -73.15 -37.35 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.03 -1.044 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -22.32 21.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.143 -0.973 . . . . 0.0 109.281 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 23.8 tttt -84.1 -25.02 30.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.251 -0.906 . . . . 0.0 109.369 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.901 ' CB ' HD21 ' A' ' 60' ' ' LEU . 2.2 m -59.54 -48.26 87.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 O-C-N 121.235 -0.916 . . . . 0.0 109.852 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 15.0 tpp -45.34 -24.62 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.738 -1.226 . . . . 0.0 109.596 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 56' ' ' VAL . 5.7 mm-40 -88.81 -42.14 12.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 109.304 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.1 m -72.44 -62.39 1.46 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.926 . . . . 0.0 109.307 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.901 HD21 ' CB ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.23 44.04 1.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 109.493 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 57' ' ' MET . 15.8 p-10 -77.9 109.98 12.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 109.337 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.523 ' CB ' ' O ' ' A' ' 67' ' ' GLU . 36.8 t30 -49.46 -52.38 29.48 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.163 -0.961 . . . . 0.0 109.44 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -165.49 22.97 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.0 109.997 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.44 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 69.78 94.61 0.06 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.44 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.2 OUTLIER 170.13 -29.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.327 -1.102 . . . . 0.0 108.366 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 110.21 17.11 9.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 62' ' ' ASN . 2.7 pt-20 -113.09 91.2 3.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.27 -1.135 . . . . 0.0 109.109 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.542 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.44 130.89 43.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.681 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.5 m-20 -101.56 170.55 8.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.409 -0.807 . . . . 0.0 108.876 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.411 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.95 -48.69 64.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.033 -1.042 . . . . 0.0 110.457 -179.702 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.51 ' O ' ' CE ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.28 -41.09 65.21 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 109.416 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.587 ' OE1' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -74.53 -23.1 58.76 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 120.929 -1.107 . . . . 0.0 109.062 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.58 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 18.3 t80 -64.07 -52.73 57.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.197 -0.939 . . . . 0.0 108.534 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.872 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.37 -37.85 82.03 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.19 -0.944 . . . . 0.0 108.995 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.529 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -72.73 -19.19 61.43 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.98 . . . . 0.0 108.939 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.882 ' HB2' HD13 ' A' ' 60' ' ' LEU . 9.8 t80 -71.84 -68.31 0.47 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.493 -0.754 . . . . 0.0 109.27 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.909 HG22 ' OE2' ' A' ' 39' ' ' GLU . 39.3 t -66.42 -31.15 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.295 -0.878 . . . . 0.0 109.452 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 74' ' ' MET . . . -59.63 -40.66 88.36 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.282 -0.886 . . . . 0.0 109.384 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.728 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 2.1 mmt -77.76 -71.18 0.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.187 -0.945 . . . . 0.0 109.693 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 1.01 HG11 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.04 -24.39 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.296 -1.502 . . . . 0.0 109.736 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.509 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 13.1 m -77.09 -68.81 0.57 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 108.665 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.34 -49.74 11.11 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.728 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.19 -40.03 0.47 Allowed 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.334 0.588 . . . . 0.0 109.589 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.04 -32.88 16.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.263 -0.898 . . . . 0.0 109.477 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -66.34 -9.95 38.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.889 . . . . 0.0 109.534 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.38 -43.43 40.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.483 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.51 -31.25 1.05 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.8 -43.84 21.71 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.902 . . . . 0.0 109.522 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 65.94 23.47 11.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.444 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.43 89.62 2.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.903 . . . . 0.0 109.465 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.454 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.542 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.289 0.566 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -58.03 -75.74 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 109.66 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.951 HD13 HG21 ' A' ' 13' ' ' VAL . 5.9 mp -76.82 -29.68 56.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.606 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.542 ' HB3' ' CB ' ' B' ' 1' ' ' SER . 41.8 tt0 -58.03 -57.69 11.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.139 -0.976 . . . . 0.0 109.146 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.1 OUTLIER -61.27 -47.04 87.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.323 -0.861 . . . . 0.0 109.166 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.56 ' HB1' ' CB ' ' A' ' 6' ' ' ALA . . . -65.36 -12.68 54.42 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.288 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.876 ' O ' HD12 ' B' ' 11' ' ' ILE . 8.6 ttt -80.81 -44.45 18.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.362 -0.836 . . . . 0.0 109.296 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.38 -44.81 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.898 . . . . 0.0 109.315 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -67.84 -55.85 11.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.291 -0.88 . . . . 0.0 109.306 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.745 HD23 HD13 ' A' ' 3' ' ' LEU . 20.9 mt -45.37 -49.8 12.75 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.249 -0.907 . . . . 0.0 109.237 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.876 HD12 ' O ' ' B' ' 7' ' ' MET . 9.3 mt -60.17 -38.64 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.302 -0.874 . . . . 0.0 109.365 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -57.58 -28.64 63.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.829 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -82.92 -30.82 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.208 -0.933 . . . . 0.0 109.268 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.486 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 22.1 t80 -60.79 -51.1 70.75 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.84 -1.162 . . . . 0.0 109.211 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.458 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -80.16 -37.64 33.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.892 . . . . 0.0 109.615 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.2 tt0 -55.67 -65.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.211 -0.931 . . . . 0.0 109.487 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.581 ' CD2' ' HG ' ' B' ' 35' ' ' LEU . 28.8 m-85 -59.48 -49.73 76.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.552 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.534 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 53.2 p -57.95 -17.27 15.98 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.583 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.94 -37.22 16.53 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CZ ' ' OE1' ' B' ' 34' ' ' GLU . 56.4 mtp85 -46.22 -44.16 15.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -1.137 . . . . 0.0 109.465 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.58 169.97 17.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.432 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -48.37 -54.37 13.16 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' O ' ' O ' ' B' ' 18' ' ' SER . 73.2 m-20 -70.15 170.96 10.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -1.118 . . . . 0.0 109.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 18' ' ' SER . 1.0 OUTLIER -141.22 70.52 1.35 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.863 . . . . 0.0 109.466 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.486 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -170.01 -36.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.362 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.536 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -121.89 170.19 10.04 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.919 . . . . 0.0 109.382 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.783 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.6 mp -102.21 144.92 30.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.952 . . . . 0.0 109.705 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -97.73 82.11 3.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' CG ' ' B' ' 57' ' ' MET . 0.0 OUTLIER 41.42 -83.87 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.591 -0.693 . . . . 0.0 110.955 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.604 ' N ' ' O ' ' B' ' 28' ' ' LYS . 4.7 t -48.5 -27.38 2.67 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.788 -1.195 . . . . 0.0 109.959 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.783 ' C ' HD23 ' B' ' 27' ' ' LEU . 2.8 mp0 -59.48 -47.01 87.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.894 -1.129 . . . . 0.0 108.38 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.655 HD21 ' CD ' ' B' ' 72' ' ' GLU . 4.1 mt -59.11 -42.99 91.85 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.965 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -45.64 -67.73 0.26 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.517 -0.739 . . . . 0.0 109.722 179.715 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.54 ' CG ' ' O ' ' B' ' 31' ' ' GLU . 12.7 pt-20 -45.49 -44.28 12.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.151 -0.968 . . . . 0.0 109.786 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.829 HD21 ' CG1' ' B' ' 13' ' ' VAL . 3.2 mt -52.28 -45.73 65.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.1 -1.0 . . . . 0.0 109.617 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 1.019 HG23 HD12 ' B' ' 40' ' ' LEU . 11.9 mt -73.14 -23.84 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.258 -0.901 . . . . 0.0 109.853 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -1.06 52.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.165 -0.959 . . . . 0.0 109.679 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -109.89 -20.06 12.89 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.159 -0.963 . . . . 0.0 109.285 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.697 ' C ' HD23 ' B' ' 40' ' ' LEU . 10.9 mm-40 -121.44 -22.14 6.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.316 -0.865 . . . . 0.0 109.612 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 1.019 HD12 HG23 ' B' ' 36' ' ' ILE . 4.5 mt -110.5 59.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.219 -0.926 . . . . 0.0 109.535 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 88.4 p -123.88 1.23 8.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.29 -0.881 . . . . 0.0 109.555 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -111.22 -66.66 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.194 -0.941 . . . . 0.0 109.391 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -78.53 -36.6 44.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 109.394 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' B' ' 40' ' ' LEU . 3.2 mp -80.3 -173.36 3.99 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.242 -0.911 . . . . 0.0 109.46 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' B' ' 46' ' ' GLU . 6.0 mt-10 -120.85 44.62 2.45 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.236 -0.915 . . . . 0.0 109.393 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' B' ' 45' ' ' GLU . 4.2 mt-10 44.41 -167.89 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.366 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.824 HD12 HG23 ' B' ' 53' ' ' VAL . 2.3 mm -100.55 81.01 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.42 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER -43.34 -38.92 2.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.5 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -163.92 70.15 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.267 -0.896 . . . . 0.0 109.211 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.538 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.5 pt20 41.91 37.48 0.81 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.435 -0.791 . . . . 0.0 109.546 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -65.23 -70.3 0.24 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 109.584 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 2.1 t -86.04 -13.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.125 -0.985 . . . . 0.0 109.439 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.965 HG11 ' CG ' ' B' ' 33' ' ' LYS . 69.0 t -81.03 -29.36 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.0 109.014 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.471 ' HB3' ' O ' ' B' ' 50' ' ' GLN . 33.6 t70 -87.5 -26.1 23.36 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.203 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.2 -40.43 18.13 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 0.0 109.454 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.778 HG22 ' O ' ' B' ' 52' ' ' VAL . 21.0 m -59.83 -45.69 94.56 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 O-C-N 121.205 -0.934 . . . . 0.0 109.606 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -43.06 -27.36 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.969 -1.082 . . . . 0.0 109.258 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' B' ' 56' ' ' VAL . 4.1 mt-10 -83.25 -43.33 16.18 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.302 -0.874 . . . . 0.0 108.793 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.893 HG21 ' SD ' ' B' ' 79' ' ' MET . 38.1 m -75.46 -65.82 0.85 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.694 HD13 ' HB2' ' B' ' 76' ' ' PHE . 5.9 mt -41.03 -55.61 2.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.467 -0.771 . . . . 0.0 109.221 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.05 109.56 20.6 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.263 -0.898 . . . . 0.0 109.521 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.423 ' OD1' ' NE2' ' B' ' 71' ' ' GLN . 0.9 OUTLIER -111.74 3.33 17.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' B' ' 64' ' ' GLY . 3.8 p30 -98.28 -45.83 6.03 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.516 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 102.06 95.13 2.26 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 57.5 t0 177.5 -32.86 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -1.134 . . . . 0.0 108.583 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.25 -21.62 24.1 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.48 ' HB3' ' HE3' ' B' ' 26' ' ' LYS . 26.0 mt-10 -75.82 106.71 7.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -1.134 . . . . 0.0 109.406 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.584 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -69.68 124.03 22.9 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.237 -0.914 . . . . 0.0 109.437 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -92.14 171.0 9.38 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.389 -0.82 . . . . 0.0 109.112 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.411 ' CE2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.43 -50.62 67.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.929 -1.107 . . . . 0.0 109.871 -179.941 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.455 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -49.21 -29.96 6.36 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.328 -0.857 . . . . 0.0 109.635 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.655 ' CD ' HD21 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -79.13 -34.05 43.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.124 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.989 ' CZ ' HD11 ' A' ' 3' ' ' LEU . 26.8 t80 -61.2 -55.88 27.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.059 -1.026 . . . . 0.0 108.993 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.505 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -62.39 -39.06 92.01 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.385 -0.822 . . . . 0.0 108.818 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -67.75 -18.9 65.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.333 -0.854 . . . . 0.0 108.819 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.853 ' CE2' HG23 ' B' ' 77' ' ' VAL . 0.0 OUTLIER -71.72 -67.46 0.53 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.415 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 1.077 HG21 HD12 ' A' ' 3' ' ' LEU . 41.4 t -56.94 -31.77 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.493 -0.754 . . . . 0.0 109.608 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.872 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -66.55 -38.86 88.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.894 . . . . 0.0 110.147 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.893 ' SD ' HG21 ' B' ' 59' ' ' THR . 9.4 mtp -78.35 -71.52 0.42 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.007 -1.058 . . . . 0.0 109.527 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.655 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -43.36 -25.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.848 0 O-C-N 120.445 -1.409 . . . . 0.0 109.654 -179.562 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.481 ' N ' ' O ' ' B' ' 79' ' ' MET . 8.8 m -78.1 -68.79 0.6 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.963 -1.086 . . . . 0.0 108.612 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.6 t -79.32 -49.96 11.62 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.0 108.628 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.62 -41.2 0.67 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.334 0.588 . . . . 0.0 109.602 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 1.7 t -89.3 -33.48 16.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 0.0 109.551 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' B' ' 81' ' ' THR . 3.2 t-160 -61.28 -15.41 34.92 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.431 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.3 -40.84 64.2 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.242 -0.911 . . . . 0.0 109.469 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -55.22 -39.63 69.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.488 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -50.76 -49.41 58.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.246 -0.909 . . . . 0.0 109.434 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -63.97 151.49 42.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.445 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -110.01 109.18 19.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.237 -0.914 . . . . 0.0 109.496 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.473 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 4' ' ' GLU . 57.6 m . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.642 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.1 OUTLIER -58.92 -71.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 109.824 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.065 HD21 HG21 ' B' ' 13' ' ' VAL . 3.2 mm? -73.23 -35.29 66.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.112 -0.992 . . . . 0.0 109.836 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 1' ' ' SER . 19.6 tp10 -55.71 -63.16 1.26 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 109.505 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.51 -47.24 86.49 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -64.49 -11.15 30.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.277 -0.889 . . . . 0.0 109.452 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 60.5 ttp -85.4 -41.24 15.61 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.465 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 11' ' ' ILE . 85.5 t -70.79 -29.79 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.988 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -78.93 -54.72 5.76 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.715 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -55.92 -46.16 78.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.532 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.596 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -59.2 -46.17 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.183 -0.948 . . . . 0.0 109.308 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.596 ' N ' HG23 ' A' ' 11' ' ' ILE . 2.7 t0 -59.01 -22.94 61.47 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.174 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 35' ' ' LEU . 2.3 t -82.79 -27.4 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.189 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 22.4 t80 -69.9 -46.64 64.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.973 -1.079 . . . . 0.0 109.45 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -34.79 49.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.649 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.87 -63.32 1.08 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.248 -0.907 . . . . 0.0 109.597 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.598 ' CD1' HG13 ' A' ' 13' ' ' VAL . 37.5 m-85 -59.14 -51.92 67.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.305 -0.872 . . . . 0.0 109.623 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.48 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 13.9 m -62.41 -12.7 23.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.215 -0.928 . . . . 0.0 109.505 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.489 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -82.83 10.67 56.43 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 -39.4 17.37 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -1.17 . . . . 0.0 109.465 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.499 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 2.6 tt0 -84.15 82.1 8.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 109.467 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.49 -132.93 12.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.475 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 1.7 m-20 -64.03 -91.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -1.142 . . . . 0.0 109.484 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.489 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 176.54 132.33 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.428 ' C ' ' HG3' ' A' ' 26' ' ' LYS . 15.3 p-80 -170.03 -53.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.149 -0.969 . . . . 0.0 109.835 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.541 ' CE ' ' HB3' ' A' ' 67' ' ' GLU . 50.4 mtmt -148.74 170.19 18.76 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.128 -0.982 . . . . 0.0 109.843 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.846 HD23 ' C ' ' A' ' 31' ' ' GLU . 5.2 mp -94.35 152.16 18.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.282 -0.887 . . . . 0.0 109.806 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -116.65 69.25 0.75 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.111 -0.993 . . . . 0.0 109.324 179.585 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HG3' ' A' ' 57' ' ' MET . 0.0 OUTLIER 62.71 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.625 -0.672 . . . . 0.0 110.639 179.352 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.5 p -50.64 -29.94 12.28 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.7 -1.25 . . . . 0.0 109.799 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.846 ' C ' HD23 ' A' ' 27' ' ' LEU . 9.6 mt-10 -66.2 -42.54 88.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.04 -1.038 . . . . 0.0 108.274 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.928 HD23 ' CE1' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -54.12 -60.74 2.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.083 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.833 ' HD2' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.71 -53.07 4.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.798 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.36 -51.2 11.51 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.238 -0.913 . . . . 0.0 109.705 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.993 HD23 ' HG3' ' A' ' 39' ' ' GLU . 0.3 OUTLIER -57.35 -55.61 32.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.329 -0.857 . . . . 0.0 109.925 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.811 HD13 HG11 ' A' ' 80' ' ' VAL . 68.0 mt -64.61 -9.36 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.188 -0.945 . . . . 0.0 109.966 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 9.2 m120 -91.31 -74.43 0.5 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.076 -1.015 . . . . 0.0 109.563 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -62.02 -12.44 18.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.689 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.993 ' HG3' HD23 ' A' ' 35' ' ' LEU . 6.1 mm-40 -110.83 -44.47 3.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.162 -0.961 . . . . 0.0 109.698 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.061 HD22 HD21 ' A' ' 44' ' ' LEU . 1.9 mt -108.4 64.94 0.62 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.128 -0.983 . . . . 0.0 109.472 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -110.76 -5.5 14.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.328 -0.857 . . . . 0.0 109.558 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -88.69 -77.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.217 -0.927 . . . . 0.0 109.445 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.17 -26.83 30.11 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.241 -0.912 . . . . 0.0 109.453 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 1.061 HD21 HD22 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -142.88 78.66 1.62 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.5 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' A' ' 41' ' ' SER . 35.5 tt0 -43.82 102.95 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.435 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 45' ' ' GLU . 3.1 mt-10 47.91 -174.87 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 109.37 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.74 HG21 HG12 ' A' ' 53' ' ' VAL . 2.5 mm -93.03 124.78 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.514 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -67.65 0.23 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.285 -0.885 . . . . 0.0 109.253 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 1.9 tt0 -139.45 42.2 2.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 109.238 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.767 ' HA ' HG12 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 68.62 56.5 0.45 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.311 -0.868 . . . . 0.0 109.34 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -88.64 -70.35 0.65 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -0.933 . . . . 0.0 109.543 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.862 ' O ' HG13 ' A' ' 56' ' ' VAL . 5.4 t -88.0 -23.36 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.13 -0.981 . . . . 0.0 109.289 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.833 HG11 ' HD2' ' A' ' 33' ' ' LYS . 2.8 p -72.5 -32.05 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.012 -1.055 . . . . 0.0 108.731 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.458 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 23.0 t0 -90.37 -37.21 14.15 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.465 -0.772 . . . . 0.0 109.139 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 1.1 ttmt -68.43 -31.82 71.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.335 -0.853 . . . . 0.0 109.427 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.985 ' HB ' HD13 ' A' ' 60' ' ' LEU . 3.7 m -57.99 -49.69 80.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 O-C-N 121.224 -0.923 . . . . 0.0 109.703 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.486 ' HG3' ' HG2' ' A' ' 29' ' ' LYS . 3.0 mmt -43.45 -26.88 0.23 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.807 -1.183 . . . . 0.0 109.496 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -78.37 -45.83 21.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.293 -0.879 . . . . 0.0 108.967 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 15.5 m -86.63 -62.16 1.57 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 109.382 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.985 HD13 ' HB ' ' A' ' 56' ' ' VAL . 4.7 mp -40.1 -28.25 0.05 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.412 -0.805 . . . . 0.0 109.981 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' MET . 8.9 p-10 -48.75 113.21 0.73 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.113 -0.992 . . . . 0.0 109.405 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -78.96 -49.97 11.9 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.209 -0.932 . . . . 0.0 109.503 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.11 -13.79 7.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.225 -0.922 . . . . 0.0 109.822 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 100.26 102.94 2.51 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HB3' ' OE1' ' A' ' 67' ' ' GLU . 0.4 OUTLIER 167.31 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -1.111 . . . . 0.0 108.519 -179.757 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.56 -20.23 25.33 Favored Glycine 0 N--CA 1.485 1.911 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB3' ' CE ' ' A' ' 26' ' ' LYS . 6.8 mt-10 -69.9 103.28 2.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -1.146 . . . . 0.0 109.133 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.537 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.94 124.11 23.21 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.263 -0.898 . . . . 0.0 109.754 -179.36 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 29.9 t0 -94.21 170.46 9.5 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.552 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.3 OUTLIER -53.96 -51.62 63.29 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 110.214 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 3.4 mt-30 -51.48 -34.66 36.63 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.21 -0.931 . . . . 0.0 109.453 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.671 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.13 -27.74 42.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.164 -0.96 . . . . 0.0 109.8 -179.73 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.715 ' CE2' HD23 ' A' ' 10' ' ' LEU . 19.5 t80 -62.47 -49.74 74.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.001 -1.062 . . . . 0.0 108.571 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -63.15 -41.67 99.31 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.037 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.51 ' HA ' ' SD ' ' B' ' 74' ' ' MET . . . -72.4 -12.07 60.96 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.928 ' CE1' HD23 ' A' ' 32' ' ' LEU . 6.7 t80 -71.58 -70.05 0.35 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 ' HG ' ' B' ' 3' ' ' LEU . 44.1 t -69.22 -25.46 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.143 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.576 ' CB ' ' HB3' ' B' ' 74' ' ' MET . . . -69.12 -34.49 75.13 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.472 -0.768 . . . . 0.0 109.527 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.722 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -79.12 -70.73 0.48 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.178 -0.951 . . . . 0.0 108.876 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.811 HG11 HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.46 -24.36 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 O-C-N 120.593 -1.317 . . . . 0.0 109.512 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.465 ' N ' ' O ' ' A' ' 79' ' ' MET . 8.2 m -78.56 -69.02 0.59 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 0.0 108.599 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.5 t -79.09 -50.1 11.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.944 . . . . 0.0 108.659 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.46 -40.41 0.56 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.329 0.585 . . . . 0.0 109.619 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.08 -31.97 16.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.516 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -64.64 -11.34 34.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 83' ' ' ALA . 11.8 pt-20 -65.4 -13.71 59.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -82.36 -22.67 35.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.231 -0.918 . . . . 0.0 109.466 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -84.63 -18.28 35.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.897 . . . . 0.0 109.477 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 89' ' ' GLU . 19.0 pt-20 -105.68 50.78 0.77 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.481 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -143.42 129.06 19.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 0.0 109.448 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.48 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.486 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 14.9 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.988 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -53.54 -60.44 3.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.254 -0.903 . . . . 0.0 109.588 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.971 ' HG ' HG21 ' A' ' 77' ' ' VAL . 3.6 mm? -69.51 -18.36 63.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.22 -0.925 . . . . 0.0 109.54 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' B' ' 1' ' ' SER . 0.6 OUTLIER -64.44 -63.4 1.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.383 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.91 -42.69 94.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.325 -0.859 . . . . 0.0 109.41 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.51 -23.13 67.17 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.237 -0.914 . . . . 0.0 109.509 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.475 ' O ' HG12 ' B' ' 11' ' ' ILE . 2.6 ttp -81.97 -29.75 32.01 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.57 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.43 HG23 ' O ' ' B' ' 4' ' ' GLU . 47.1 t -72.52 -35.81 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.642 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -74.62 -52.23 12.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 109.499 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.98 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -57.33 -45.96 83.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.207 -0.933 . . . . 0.0 109.485 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.856 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 15.1 mm -55.07 -49.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.97 -20.54 66.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 1.065 HG21 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -76.33 -39.06 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 0.0 109.38 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 25.0 t80 -67.87 -46.4 71.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.956 -1.09 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.471 ' O ' ' HB2' ' B' ' 18' ' ' SER . 4.8 m80 -64.92 -54.59 28.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 0.0 109.66 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -56.14 -65.09 0.66 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.206 -0.934 . . . . 0.0 109.501 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.673 ' CZ ' HD12 ' B' ' 35' ' ' LEU . 39.1 m-85 -53.1 -20.39 3.68 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.282 -0.886 . . . . 0.0 109.474 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' B' ' 15' ' ' HIS . 0.5 OUTLIER -71.88 -50.63 27.66 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.722 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 19' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' B' ' 23' ' ' ASP . . . -90.5 53.78 3.45 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 15.0 mmm180 -90.2 -46.91 8.13 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -1.167 . . . . 0.0 109.603 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -139.1 81.47 1.84 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.177 -0.952 . . . . 0.0 109.85 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 85.5 -93.0 1.8 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' B' ' 18' ' ' SER . 16.2 m-20 -42.18 150.34 0.13 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.372 -1.075 . . . . 0.0 109.736 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' B' ' 24' ' ' LYS . 1.9 tmmt? -144.12 58.56 1.35 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 33.8 t60 -170.23 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 109.479 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -122.54 169.98 10.46 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 109.38 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.518 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 28.8 mt -119.34 127.81 53.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.947 . . . . 0.0 110.325 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -74.53 153.37 39.1 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.375 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.524 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 16.4 ttmt -36.86 -31.33 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.425 -0.797 . . . . 0.0 109.728 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 28' ' ' LYS . 2.8 t -72.35 -52.36 16.48 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.335 -0.853 . . . . 0.0 109.314 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -49.0 -44.95 41.71 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.115 -0.991 . . . . 0.0 108.553 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.52 HD21 ' CB ' ' B' ' 68' ' ' CYS . 28.7 mt -51.87 -67.13 0.28 Allowed 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.63 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.01 -28.92 0.09 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.416 -0.803 . . . . 0.0 109.789 179.861 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -70.06 -60.07 2.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.176 -0.952 . . . . 0.0 109.411 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.892 HD21 ' CE1' ' B' ' 73' ' ' PHE . 11.9 tp -45.36 -48.44 13.33 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 0.0 109.654 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.89 HD13 HG11 ' B' ' 80' ' ' VAL . 31.1 mt -66.49 -34.64 71.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.213 -0.929 . . . . 0.0 109.562 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.473 ' OD1' HD11 ' B' ' 47' ' ' ILE . 3.7 m120 -86.14 7.15 26.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -0.903 . . . . 0.0 109.597 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.512 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 4.4 m-80 -105.21 -46.85 4.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.687 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.526 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 40.6 mp0 -124.9 -10.43 7.19 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.795 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.699 HD21 HG23 ' B' ' 81' ' ' THR . 0.1 OUTLIER -102.47 -4.49 25.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 0.0 109.55 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -10.44 27.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.971 . . . . 0.0 109.483 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -77.01 -44.52 30.6 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' PHE . . . . . 0.537 ' O ' HD23 ' B' ' 44' ' ' LEU . 0.2 OUTLIER -93.95 17.44 12.25 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.309 -0.869 . . . . 0.0 109.375 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.68 HD11 HD12 ' B' ' 40' ' ' LEU . 5.6 mt -141.41 101.33 3.98 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.281 -0.887 . . . . 0.0 109.358 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -65.59 87.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.238 -0.914 . . . . 0.0 109.528 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.476 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 2.3 tt0 66.38 30.25 8.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.934 . . . . 0.0 109.415 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.739 HG22 ' O ' ' B' ' 49' ' ' GLU . 35.0 mm 65.22 9.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 36.19 44.68 0.29 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.671 -0.643 . . . . 0.0 109.846 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.739 ' O ' HG22 ' B' ' 47' ' ' ILE . 1.6 pt-20 86.54 -172.47 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.528 ' CG ' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -85.07 63.92 8.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.012 -1.055 . . . . 0.0 109.539 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.422 ' HB3' ' HE2' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -90.64 -70.45 0.68 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.152 -179.731 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.866 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.5 t -88.64 -25.0 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.102 -0.999 . . . . 0.0 109.623 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.63 HG11 ' CG ' ' B' ' 33' ' ' LYS . 2.5 t -72.46 -29.62 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 O-C-N 120.983 -1.073 . . . . 0.0 108.228 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.452 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.79 -42.13 10.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.0 109.123 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -33.56 76.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.349 -0.844 . . . . 0.0 109.589 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.939 ' HB ' HD13 ' B' ' 60' ' ' LEU . 2.9 m -52.55 -55.25 11.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.593 ' H ' HG23 ' B' ' 56' ' ' VAL . 2.5 tpt -40.17 -34.28 0.3 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.072 -1.017 . . . . 0.0 109.692 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.23 -56.83 10.58 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.257 -0.902 . . . . 0.0 108.772 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.719 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.9 m -76.53 -65.5 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.356 -0.84 . . . . 0.0 108.864 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 1.046 HD21 ' CG ' ' B' ' 76' ' ' PHE . 4.6 mp -32.44 -38.1 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.308 0.575 . . . . 0.0 110.258 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 59' ' ' THR . 37.9 t0 -84.92 71.43 10.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.907 . . . . 0.0 109.507 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -86.99 -10.42 53.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 109.429 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.51 -41.64 9.24 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.23 -0.919 . . . . 0.0 109.444 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.74 89.58 1.96 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 175.54 -31.97 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.313 -1.11 . . . . 0.0 108.662 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.09 -32.18 6.89 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 3.6 mm-40 -69.93 126.82 30.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.339 -1.094 . . . . 0.0 109.31 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.575 ' CA ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -78.47 130.57 36.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.087 -1.008 . . . . 0.0 109.561 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -105.26 170.39 7.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.269 -0.894 . . . . 0.0 109.286 179.708 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.856 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 0.9 OUTLIER -49.4 -55.98 11.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.99 -1.069 . . . . 0.0 110.511 -179.742 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.588 ' O ' ' HE3' ' B' ' 74' ' ' MET . 2.3 mt-30 -50.82 -32.63 20.71 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.177 -0.952 . . . . 0.0 109.73 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.887 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -75.78 -32.71 60.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.948 -1.095 . . . . 0.0 109.543 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.98 ' CE2' HD23 ' B' ' 10' ' ' LEU . 3.0 t80 -62.66 -53.58 52.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.174 -0.954 . . . . 0.0 108.91 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.588 ' HE3' ' O ' ' B' ' 71' ' ' GLN . 0.0 OUTLIER -55.28 -46.96 76.15 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.541 -0.725 . . . . 0.0 109.795 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.986 ' HB1' ' CE ' ' B' ' 79' ' ' MET . . . -75.16 -14.28 60.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.075 -1.016 . . . . 0.0 109.195 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 1.046 ' CG ' HD21 ' B' ' 60' ' ' LEU . 1.9 t80 -71.83 -70.24 0.34 Allowed 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.396 -0.815 . . . . 0.0 109.317 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.47 -46.14 93.1 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.589 -0.694 . . . . 0.0 109.609 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.782 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -51.99 -41.41 62.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.439 -0.788 . . . . 0.0 110.551 -179.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.986 ' CE ' ' HB1' ' B' ' 75' ' ' ALA . 12.6 mtm -69.83 -69.68 0.33 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.76 -1.213 . . . . 0.0 109.059 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.89 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -42.49 -23.96 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 120.867 -1.146 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.699 HG23 HD21 ' B' ' 40' ' ' LEU . 0.6 OUTLIER -77.54 -68.77 0.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.832 -1.168 . . . . 0.0 108.899 178.861 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -78.18 -49.95 12.86 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.138 -0.976 . . . . 0.0 108.367 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.77 -43.25 0.42 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.235 0.54 . . . . 0.0 109.846 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.466 ' SG ' ' HE3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -90.17 -31.94 16.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.532 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -50.99 -34.59 29.68 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.285 -0.885 . . . . 0.0 109.584 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -46.67 -45.89 19.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.241 -0.912 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -46.38 -51.25 15.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.495 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' B' ' 87' ' ' PHE . 1.9 t80 -43.97 -69.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.477 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' B' ' 90' ' ' HIS . 0.0 OUTLIER -133.43 161.85 33.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 109.517 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER 71.17 56.66 0.21 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -0.894 . . . . 0.0 109.483 -179.994 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 91' ' ' GLU . . . . . 0.402 ' HG2' ' HA ' ' B' ' 87' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.437 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.553 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.5 tp10 -64.58 -77.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.544 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.758 HD13 HG21 ' B' ' 13' ' ' VAL . 7.2 mp -71.5 -30.17 65.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -56.32 -57.64 11.41 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.0 109.459 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -62.03 -40.15 94.74 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.464 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.639 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -66.45 -17.06 64.58 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.464 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.524 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 36.3 ttp -84.46 -36.19 22.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.891 . . . . 0.0 109.514 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 t -68.03 -42.0 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.948 . . . . 0.0 109.522 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -77.32 -59.78 2.64 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.525 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 85.4 mt -47.77 -48.71 30.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.555 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.75 HD13 ' CZ ' ' A' ' 70' ' ' PHE . 23.6 mm -57.78 -48.14 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 3.1 t0 -62.98 -19.65 64.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.916 . . . . 0.0 109.554 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.827 HG21 ' CD1' ' B' ' 3' ' ' LEU . 2.4 t -80.65 -29.72 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.301 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 18' ' ' SER . 15.1 t80 -73.73 -45.07 54.34 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.003 -1.061 . . . . 0.0 109.295 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.546 ' CE1' ' HD3' ' A' ' 24' ' ' LYS . 4.9 t60 -78.79 -29.36 44.93 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.301 -0.875 . . . . 0.0 109.617 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.6 tt0 -75.8 -62.25 1.65 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.494 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CD1' HG13 ' A' ' 13' ' ' VAL . 27.9 m-85 -55.82 -48.09 76.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 14' ' ' PHE . 1.2 t -67.62 -20.04 65.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.923 . . . . 0.0 109.427 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.469 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -89.75 17.61 51.74 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -88.61 -57.53 2.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -1.166 . . . . 0.0 109.448 -179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -113.53 140.4 48.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.221 -0.924 . . . . 0.0 109.449 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.24 -119.11 4.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.491 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 4.2 m-20 -122.25 -80.67 0.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.224 -1.162 . . . . 0.0 109.463 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HD3' ' CE1' ' A' ' 15' ' ' HIS . 0.0 OUTLIER 165.51 99.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.499 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.546 ' CG ' ' O ' ' A' ' 24' ' ' LYS . 24.5 m80 -164.24 -41.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.542 ' CD ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -142.35 170.31 15.94 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.241 -0.912 . . . . 0.0 109.446 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.709 HD22 ' HB3' ' A' ' 31' ' ' GLU . 75.1 mt -112.01 134.26 53.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.92 . . . . 0.0 109.823 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 29' ' ' LYS . 3.6 mttt -81.79 165.16 21.14 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 28' ' ' LYS . 11.1 ptpt -45.0 -26.29 0.41 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.11 -0.994 . . . . 0.0 109.141 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 28' ' ' LYS . 4.9 p -82.43 -42.94 17.92 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.3 -0.875 . . . . 0.0 110.039 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HB3' HD22 ' A' ' 27' ' ' LEU . 36.4 mm-40 -56.84 -42.91 80.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.972 -1.08 . . . . 0.0 108.666 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.839 HD21 ' SG ' ' A' ' 68' ' ' CYS . 29.8 mt -62.66 -62.74 1.53 Allowed 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.886 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.62 -28.44 0.07 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.415 -0.803 . . . . 0.0 109.677 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -70.97 -58.36 3.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.441 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.852 HD22 HD21 ' B' ' 3' ' ' LEU . 12.6 mt -51.88 -39.58 59.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.278 -0.888 . . . . 0.0 109.736 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.826 HG22 HD22 ' A' ' 44' ' ' LEU . 0.9 OUTLIER -74.26 -29.17 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.44 ' OD1' ' HG3' ' A' ' 46' ' ' GLU . 1.8 m-80 -88.77 -3.14 58.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.93 . . . . 0.0 109.599 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -102.33 -45.91 4.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.188 -0.945 . . . . 0.0 109.512 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.515 ' HG3' ' N ' ' B' ' 4' ' ' GLU . 0.6 OUTLIER -106.14 -18.32 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.732 HD23 HD13 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -115.12 72.48 0.8 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.391 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -118.29 -7.82 10.67 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 109.502 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.89 -85.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.167 -0.958 . . . . 0.0 109.41 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -69.96 -30.89 68.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.298 -0.876 . . . . 0.0 109.345 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.826 HD22 HG22 ' A' ' 36' ' ' ILE . 4.1 mp -77.05 -29.72 55.27 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.436 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 44' ' ' LEU . 8.9 pt-20 40.15 71.33 0.19 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.505 -0.747 . . . . 0.0 109.835 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' CG ' ' O ' ' A' ' 46' ' ' GLU . 1.3 tt0 44.14 46.17 7.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.924 . . . . 0.0 109.331 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.828 HG13 HG21 ' A' ' 53' ' ' VAL . 0.9 OUTLIER 51.54 -147.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.237 -0.914 . . . . 0.0 109.161 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 47' ' ' ILE . 8.9 pttt 173.81 -49.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.97 . . . . 0.0 109.24 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.425 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -131.5 21.19 4.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.371 -0.831 . . . . 0.0 109.062 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mp0 65.48 59.62 0.78 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 0.0 109.32 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.7 -70.36 0.67 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.254 -0.904 . . . . 0.0 109.522 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.785 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.5 t -86.2 -21.13 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.313 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.886 HG11 ' HG3' ' A' ' 33' ' ' LYS . 89.8 t -76.63 -28.37 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.036 . . . . 0.0 109.114 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 28.9 t0 -90.16 -34.88 15.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.289 -0.882 . . . . 0.0 109.448 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -40.81 62.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.216 -0.928 . . . . 0.0 109.692 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.785 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.9 m -62.65 -49.44 83.75 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.075 -1.015 . . . . 0.0 109.622 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.616 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 13.2 tpp -41.98 -25.94 0.08 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.725 -1.234 . . . . 0.0 109.49 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.4 tm-20 -79.72 -50.95 9.84 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.071 -1.018 . . . . 0.0 109.935 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.566 ' CG2' ' N ' ' A' ' 60' ' ' LEU . 2.3 t -77.7 -52.88 8.25 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.899 -1.126 . . . . 0.0 109.782 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.611 HD22 ' HB2' ' A' ' 76' ' ' PHE . 20.4 mt -40.54 -52.67 2.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -71.96 113.28 8.83 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.376 -0.828 . . . . 0.0 109.557 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -110.26 25.73 11.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.335 -0.853 . . . . 0.0 109.38 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.0 -37.01 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.262 -0.898 . . . . 0.0 109.461 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 91.42 73.97 1.27 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.7 OUTLIER -177.39 30.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -1.154 . . . . 0.0 108.471 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.51 63.83 3.82 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.542 ' HB2' ' CD ' ' A' ' 26' ' ' LYS . 3.6 pt-20 -162.96 110.85 1.26 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.326 -1.103 . . . . 0.0 109.298 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.839 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.8 m -69.59 167.58 16.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -127.4 172.11 10.94 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.75 ' CZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.18 -62.13 2.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.648 -1.282 . . . . 0.0 110.352 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.961 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.0 pt20 -48.08 -27.08 2.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.151 -0.968 . . . . 0.0 108.845 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -74.82 -42.8 57.36 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.633 -0.667 . . . . 0.0 109.695 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.786 ' HE1' HD13 ' A' ' 35' ' ' LEU . 32.4 t80 -54.02 -46.85 71.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.317 -0.864 . . . . 0.0 109.611 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . 1.075 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 1.6 tpp -63.8 -54.63 32.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 109.336 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.738 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -64.46 -10.62 26.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.241 -0.912 . . . . 0.0 109.534 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.695 ' CE1' HG21 ' A' ' 80' ' ' VAL . 0.2 OUTLIER -74.39 -64.02 1.11 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.664 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.578 ' HB ' ' HE2' ' B' ' 74' ' ' MET . 87.0 t -58.2 -23.8 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.897 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.67 -40.76 88.75 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.525 -0.734 . . . . 0.0 109.19 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.709 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -77.75 -70.95 0.44 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.271 -0.893 . . . . 0.0 109.512 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.721 ' HB ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -44.05 -24.67 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 120.502 -1.374 . . . . 0.0 110.035 -179.13 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.487 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.2 m -79.64 -66.73 0.84 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.919 -1.113 . . . . 0.0 108.433 178.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.547 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.9 m -78.4 -53.9 6.76 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.88 -44.32 0.49 Allowed 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.259 0.552 . . . . 0.0 109.782 179.156 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.02 -47.43 65.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.564 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.27 -12.06 26.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.288 -0.883 . . . . 0.0 109.518 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -90.02 -31.86 17.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.42 ' O ' ' C ' ' A' ' 88' ' ' PHE . 0.2 OUTLIER -69.65 -27.78 65.34 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.454 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.453 ' CD1' ' O ' ' A' ' 89' ' ' GLU . 61.7 t80 -44.17 -66.99 0.32 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.428 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.453 ' O ' ' CD1' ' A' ' 88' ' ' PHE . 0.7 OUTLIER 44.43 -163.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.278 -0.889 . . . . 0.0 109.508 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -106.69 50.75 0.76 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 109.478 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.466 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.691 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.19 -70.74 0.11 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.0 109.791 -179.797 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.852 HD21 HD22 ' A' ' 35' ' ' LEU . 7.8 mp -74.64 -37.81 62.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.077 -1.014 . . . . 0.0 109.809 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -52.7 -62.39 1.68 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.952 . . . . 0.0 109.547 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.538 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.0 OUTLIER -60.94 -47.72 85.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.292 -0.88 . . . . 0.0 109.646 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.594 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -60.82 -13.8 17.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.239 -0.913 . . . . 0.0 109.627 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.621 ' O ' HD12 ' B' ' 11' ' ' ILE . 42.6 ttp -83.72 -49.34 9.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.51 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.538 HG12 ' O ' ' B' ' 5' ' ' LYS . 5.8 p -61.6 -34.28 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.285 -0.884 . . . . 0.0 109.648 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.553 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -73.33 -60.25 2.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.538 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.639 HD23 ' CB ' ' A' ' 6' ' ' ALA . 2.0 mm? -44.01 -49.54 8.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.42 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.621 HD12 ' O ' ' B' ' 7' ' ' MET . 13.6 mt -57.53 -47.97 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.233 -0.917 . . . . 0.0 109.548 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -51.34 -27.71 10.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.923 . . . . 0.0 109.474 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.846 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -84.79 -33.18 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.511 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 5.2 t80 -61.2 -49.11 78.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.882 -1.136 . . . . 0.0 109.471 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -78.06 -37.57 46.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.281 -0.887 . . . . 0.0 109.738 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 1.4 tp60 -60.07 -67.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.556 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.555 ' CD1' HG13 ' B' ' 13' ' ' VAL . 53.0 m-85 -57.99 -54.11 50.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 6.4 m -62.82 -12.7 26.28 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.0 109.589 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.88 -21.33 26.12 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.439 ' HB3' ' OE2' ' B' ' 21' ' ' GLU . 5.0 mmt180 -54.95 -47.04 75.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -1.117 . . . . 0.0 109.501 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.439 ' OE2' ' HB3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -168.83 147.98 4.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.491 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.77 -111.24 2.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.448 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -107.98 -78.76 0.58 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.204 -1.174 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER 168.56 -35.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 26.8 m80 -115.95 18.13 15.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.913 . . . . 0.0 109.429 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.489 ' HD2' ' HB2' ' B' ' 67' ' ' GLU . 30.5 mtmt -144.5 152.99 41.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.95 HD21 HD12 ' B' ' 35' ' ' LEU . 3.5 mp -93.59 142.77 26.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.129 -0.982 . . . . 0.0 109.739 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.589 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -98.78 86.29 3.49 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.365 -0.835 . . . . 0.0 109.099 179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 43.39 -86.18 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.43 -0.794 . . . . 0.0 110.826 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.589 ' N ' ' O ' ' B' ' 28' ' ' LYS . 39.1 t -47.82 -33.12 6.87 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.298 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.884 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.1 OUTLIER -56.25 -44.25 79.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.795 -1.19 . . . . 0.0 109.216 -179.784 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.631 HD23 HD22 ' B' ' 27' ' ' LEU . 5.2 mt -65.33 -52.82 51.32 Favored 'General case' 0 C--N 1.297 -1.712 0 O-C-N 121.479 -0.763 . . . . 0.0 109.124 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.82 ' HG2' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.89 -64.27 0.61 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.39 -0.819 . . . . 0.0 109.884 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.544 ' HG3' ' CE2' ' B' ' 17' ' ' TYR . 5.0 pt-20 -47.34 -56.37 6.99 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.128 -0.983 . . . . 0.0 109.69 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.95 HD12 HD21 ' B' ' 27' ' ' LEU . 2.8 mt -43.51 -39.04 3.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.212 -0.93 . . . . 0.0 109.771 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 1.05 HD12 HG22 ' B' ' 53' ' ' VAL . 0.5 OUTLIER -69.46 -52.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.252 -0.905 . . . . 0.0 109.529 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.596 ' ND2' HG13 ' B' ' 47' ' ' ILE . 18.4 m120 -89.11 20.79 3.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 109.786 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 13.8 t-20 -118.23 -36.12 3.65 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.973 . . . . 0.0 109.491 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 10.1 mm-40 -121.18 -14.27 8.39 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.23 -0.918 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.803 ' HB3' HD11 ' B' ' 44' ' ' LEU . 1.1 mt -113.25 52.97 0.77 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.3 t -111.73 37.87 2.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.71 -78.63 0.58 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.476 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -79.91 -46.17 17.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.803 HD11 ' HB3' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -92.58 54.01 2.18 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.236 -0.915 . . . . 0.0 109.553 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.29 71.2 10.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.252 -0.905 . . . . 0.0 109.433 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 0.3 OUTLIER -137.35 -88.41 0.27 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.938 HG22 ' H ' ' B' ' 49' ' ' GLU . 26.8 mm 66.66 -83.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.487 -0.758 . . . . 0.0 109.828 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.588 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 88.89 8.25 0.12 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.564 -0.71 . . . . 0.0 109.495 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.938 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.1 tt0 79.68 8.69 1.62 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.47 -0.769 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -176.19 21.25 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.73 -1.231 . . . . 0.0 111.475 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 51.5 tp10 -91.02 -70.74 0.67 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.488 -1.383 . . . . 0.0 109.331 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.775 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.2 t -93.56 -19.38 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.261 -0.899 . . . . 0.0 108.666 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.05 HG22 HD12 ' B' ' 36' ' ' ILE . 4.7 t -78.91 -20.44 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.369 -0.832 . . . . 0.0 109.233 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -85.1 -37.42 20.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.437 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -40.04 30.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 109.422 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' B' ' 52' ' ' VAL . 34.1 m -63.9 -46.07 95.18 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 O-C-N 121.211 -0.931 . . . . 0.0 109.62 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 4.9 tpt -41.87 -27.46 0.12 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.06 -1.025 . . . . 0.0 109.591 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.2 OUTLIER -84.5 -42.84 15.15 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.235 -0.916 . . . . 0.0 108.913 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.451 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.8 m -75.92 -63.99 1.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.353 -0.842 . . . . 0.0 109.753 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.69 HD22 ' HB2' ' B' ' 76' ' ' PHE . 3.8 mt -41.24 -39.43 1.35 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD2' ' HE2' ' B' ' 57' ' ' MET . 50.2 m-20 -90.22 111.87 23.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.283 -0.885 . . . . 0.0 109.431 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' B' ' 72' ' ' GLU . 11.3 p-10 -95.99 -13.59 23.68 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.188 -0.945 . . . . 0.0 109.63 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' ASP . . . . . 0.409 ' HB3' ' OE2' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -105.73 -22.01 13.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.612 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' B' ' 65' ' ' ASP . . . 80.68 99.82 0.33 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' ASP . . . . . 0.495 ' CB ' ' O ' ' B' ' 64' ' ' GLY . 0.5 OUTLIER 164.87 -26.16 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.25 -1.147 . . . . 0.0 108.608 -179.787 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 66' ' ' GLY . . . . . 0.466 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.56 23.44 5.97 Favored Glycine 0 N--CA 1.484 1.874 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' B' ' 67' ' ' GLU . 3.3 pt-20 -110.49 86.27 2.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.366 -1.079 . . . . 0.0 109.316 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 13.1 t -69.9 156.24 39.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.214 -0.929 . . . . 0.0 109.78 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.3 OUTLIER -118.71 171.42 8.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.438 -0.789 . . . . 0.0 108.996 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.45 -51.57 67.92 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.228 -0.92 . . . . 0.0 110.335 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.589 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 16.7 pt20 -57.39 -37.97 73.52 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.411 -0.805 . . . . 0.0 109.222 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.498 ' HG2' ' HG3' ' B' ' 71' ' ' GLN . 1.8 mt-10 -79.3 -15.72 57.51 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.445 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.596 ' CE2' HD12 ' B' ' 10' ' ' LEU . 5.8 t80 -71.05 -63.41 1.11 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 108.708 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.897 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -60.56 -37.78 82.39 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.426 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.844 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -59.58 -37.35 78.29 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.874 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.0 OUTLIER -57.59 -67.39 0.34 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.813 HG23 ' CE2' ' B' ' 76' ' ' PHE . 49.4 t -52.9 -21.95 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 1.075 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -57.42 -58.0 10.18 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.482 -0.761 . . . . 0.0 108.953 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.701 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 27.0 mmm -70.82 -65.56 0.72 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.433 -0.792 . . . . 0.0 109.284 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.874 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -41.5 -25.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.655 -1.278 . . . . 0.0 110.12 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 11' ' ' ILE . 5.3 m -75.75 -70.13 0.45 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.886 -1.134 . . . . 0.0 108.673 178.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -79.11 -49.53 12.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.0 108.327 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.94 -44.0 0.75 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.249 0.547 . . . . 0.0 109.789 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.527 ' HB3' ' CB ' ' B' ' 44' ' ' LEU . 0.5 OUTLIER -90.22 -27.92 19.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.268 -0.895 . . . . 0.0 109.702 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.573 ' O ' ' CD1' ' B' ' 88' ' ' PHE . 81.4 t60 -70.81 -9.34 57.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 109.727 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -9.56 55.88 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.214 -0.929 . . . . 0.0 109.724 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -46.86 85.17 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.0 109.808 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.573 ' CD1' ' O ' ' B' ' 85' ' ' HIS . 0.2 OUTLIER -55.55 -23.29 25.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.699 -179.694 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.55 ' N ' ' CD1' ' B' ' 88' ' ' PHE . 0.2 OUTLIER 47.42 -174.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.0 109.449 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.63 165.4 6.76 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.918 . . . . 0.0 109.503 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.458 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.866 ' OE2' HG23 ' B' ' 13' ' ' VAL . 3.7 tt0 -62.03 -71.47 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -0.933 . . . . 0.0 109.493 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.964 HD13 HG21 ' B' ' 13' ' ' VAL . 7.4 mp -71.98 -33.99 68.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.555 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.55 ' OE2' ' CE1' ' B' ' 42' ' ' HIS . 1.6 tt0 -54.13 -61.7 2.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.219 -0.926 . . . . 0.0 109.492 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -61.56 -47.19 86.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.964 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -59.79 -15.28 19.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.279 -0.888 . . . . 0.0 109.375 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.768 ' HE3' HD11 ' B' ' 40' ' ' LEU . 2.9 tpp -82.25 -63.77 1.31 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.213 -0.929 . . . . 0.0 109.539 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.414 ' C ' ' O ' ' A' ' 7' ' ' MET . 19.1 t -44.27 -44.92 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.145 -0.972 . . . . 0.0 109.633 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.687 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -67.15 -60.14 2.86 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.964 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.5 mt -47.66 -70.26 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.212 -0.93 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.695 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 40.5 mt -41.65 -36.95 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.418 -0.801 . . . . 0.0 110.025 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.517 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 2.8 m-20 -60.6 -48.88 79.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.159 -0.963 . . . . 0.0 110.044 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.479 HG21 HD21 ' B' ' 3' ' ' LEU . 1.1 t -62.85 -28.55 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.4 t80 -67.51 -41.97 83.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.9 -1.125 . . . . 0.0 109.601 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -73.43 -34.35 65.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.29 -0.881 . . . . 0.0 110.019 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.517 ' CG ' ' O ' ' A' ' 12' ' ' ASP . 2.1 mt-30 -69.4 -63.31 1.09 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.062 -1.024 . . . . 0.0 109.678 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.783 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 11.5 m-85 -49.88 -44.42 49.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.377 -0.827 . . . . 0.0 109.908 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -65.2 -32.84 74.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.146 -0.971 . . . . 0.0 109.52 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.21 -13.97 30.74 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.535 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 10.0 mtp85 -81.65 -32.84 31.69 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 109.527 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.47 ' OE1' ' HB2' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -79.42 134.01 36.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.286 -0.884 . . . . 0.0 109.434 179.993 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.43 -24.91 1.81 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.47 ' HB2' ' OE1' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -72.11 -46.52 56.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.239 -1.153 . . . . 0.0 109.487 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 18' ' ' SER . 1.2 mttm 66.94 60.33 0.53 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.92 . . . . 0.0 109.43 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.439 ' HB3' ' HD3' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -170.23 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.217 -0.927 . . . . 0.0 109.759 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -142.65 169.93 16.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.158 -0.964 . . . . 0.0 109.783 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.883 HD22 ' HB3' ' A' ' 31' ' ' GLU . 22.0 mt -97.55 163.12 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.29 -0.881 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -126.97 69.95 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.128 -0.983 . . . . 0.0 109.936 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 32' ' ' LEU . 16.5 tptm 63.85 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.468 -0.77 . . . . 0.0 110.695 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.6 p -46.23 -41.42 12.85 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.146 -0.971 . . . . 0.0 110.273 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.883 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -62.28 -39.96 94.68 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.971 -1.08 . . . . 0.0 108.845 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 76' ' ' PHE . 70.0 mt -58.21 -71.05 0.12 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.777 -0.577 . . . . 0.0 109.459 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.92 ' HG3' HD22 ' A' ' 37' ' ' ASN . 0.0 OUTLIER -43.89 -39.12 3.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.249 -0.907 . . . . 0.0 109.39 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -59.54 4.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.209 -0.932 . . . . 0.0 109.218 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.783 HD12 ' CZ ' ' A' ' 17' ' ' TYR . 13.4 tp -57.23 -55.54 33.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.418 -0.801 . . . . 0.0 109.404 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.916 HD11 ' CE1' ' A' ' 76' ' ' PHE . 2.2 mt -43.65 -29.0 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.36 -0.838 . . . . 0.0 109.254 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.92 HD22 ' HG3' ' A' ' 33' ' ' LYS . 61.0 m-20 -82.92 -40.63 19.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.251 -0.906 . . . . 0.0 109.812 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -95.31 21.22 8.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.187 -0.946 . . . . 0.0 109.777 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.985 ' HG3' HD12 ' A' ' 40' ' ' LEU . 22.8 pt-20 -129.52 -45.95 1.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.114 -0.992 . . . . 0.0 109.721 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.99 HD22 HD21 ' A' ' 44' ' ' LEU . 3.5 mp -76.67 -17.26 59.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.127 -0.983 . . . . 0.0 109.604 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 1.7 t 79.13 54.94 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.443 -0.786 . . . . 0.0 110.724 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.484 ' CB ' ' O ' ' A' ' 41' ' ' SER . 8.0 m-70 74.48 -4.11 2.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.16 -0.963 . . . . 0.0 110.447 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.552 ' CB ' ' HB3' ' A' ' 40' ' ' LEU . 1.6 t80 -56.94 -18.51 13.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.888 -1.133 . . . . 0.0 108.677 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.99 HD21 HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -161.61 43.19 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.506 -0.746 . . . . 0.0 109.359 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -43.92 -77.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.934 . . . . 0.0 109.509 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.9 OUTLIER -87.69 17.0 5.01 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.334 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.768 HG21 ' HA ' ' A' ' 50' ' ' GLN . 4.0 mt 60.17 120.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.3 -0.875 . . . . 0.0 109.39 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -44.69 -26.43 0.38 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.238 -0.914 . . . . 0.0 109.257 179.79 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER 172.96 49.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.314 -0.866 . . . . 0.0 109.271 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.768 ' HA ' HG21 ' A' ' 47' ' ' ILE . 4.1 mp0 44.15 48.38 7.62 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.23 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -90.12 -53.55 4.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.912 -179.667 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.997 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.0 t -96.05 -20.21 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.129 -0.982 . . . . 0.0 110.041 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.702 HG21 ' CE ' ' A' ' 33' ' ' LYS . 37.1 t -81.5 -30.33 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.772 -1.205 . . . . 0.0 108.698 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -90.01 -24.4 21.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.405 -0.809 . . . . 0.0 108.848 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.8 OUTLIER -82.59 -48.42 11.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.38 -0.825 . . . . 0.0 109.208 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.792 HG21 ' CE1' ' A' ' 76' ' ' PHE . 33.0 m -57.6 -44.77 85.89 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 O-C-N 121.158 -0.964 . . . . 0.0 109.26 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.584 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -37.39 -30.87 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.483 -0.761 . . . . 0.0 109.632 -179.801 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.36 -44.99 12.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.937 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 56' ' ' VAL . 15.8 m -63.9 -65.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.831 HD13 ' CE2' ' A' ' 76' ' ' PHE . 3.3 mt -40.15 -66.76 0.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.444 -0.785 . . . . 0.0 109.602 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.412 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -45.76 94.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.45 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 60' ' ' LEU . 2.1 m-20 -109.62 -5.14 15.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.555 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -100.61 -39.79 7.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.206 -0.934 . . . . 0.0 109.383 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 68.92 0.83 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -168.76 25.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -1.153 . . . . 0.0 108.6 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.412 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 49.11 27.63 7.27 Favored Glycine 0 N--CA 1.482 1.705 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.464 ' OE1' ' HG3' ' A' ' 26' ' ' LYS . 51.0 mm-40 -124.27 133.54 53.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.255 -1.144 . . . . 0.0 109.543 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 15.7 t -78.02 158.95 29.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.275 -0.891 . . . . 0.0 109.614 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.4 OUTLIER -127.21 171.63 11.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 108.877 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.695 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -58.61 -54.02 51.77 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.293 -0.88 . . . . 0.0 110.488 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.435 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 1.2 pm0 -56.21 -29.71 61.31 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.093 -1.005 . . . . 0.0 108.887 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 6.8 mt-10 -80.13 -25.41 39.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 109.513 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.498 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 8.3 t80 -67.63 -55.65 12.46 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.307 -0.871 . . . . 0.0 108.83 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.539 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 8.9 mtt -61.34 -37.74 84.41 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.526 ' O ' ' CG ' ' A' ' 79' ' ' MET . . . -71.67 -19.9 62.02 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.47 -0.769 . . . . 0.0 109.018 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -72.96 -69.56 0.41 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.792 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.914 HG22 ' CD ' ' A' ' 39' ' ' GLU . 42.0 t -54.61 -38.81 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.241 -0.912 . . . . 0.0 109.647 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.7 ' HB1' ' HB3' ' B' ' 74' ' ' MET . . . -65.76 -29.53 70.05 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.309 -0.869 . . . . 0.0 109.924 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.9 mmm -82.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.045 -1.034 . . . . 0.0 109.57 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.997 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.75 -20.81 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 O-C-N 120.399 -1.438 . . . . 0.0 109.709 -179.085 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.575 HG23 ' N ' ' A' ' 82' ' ' THR . 4.8 t -87.81 -50.93 6.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.795 -1.191 . . . . 0.0 109.371 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.586 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.2 t -90.32 -51.46 5.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.867 -1.145 . . . . 0.0 107.973 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.45 -37.04 0.08 Allowed 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.275 0.559 . . . . 0.0 109.946 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' A' ' 82' ' ' THR . 3.8 t -90.02 -38.04 13.88 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' A' ' 82' ' ' THR . 28.4 t60 -55.46 -18.33 6.86 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.222 -0.924 . . . . 0.0 109.489 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.512 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 0.8 OUTLIER -57.54 -41.56 81.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.516 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -62.76 -43.69 98.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.225 -0.922 . . . . 0.0 109.52 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -54.24 -64.28 0.88 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.169 -0.957 . . . . 0.0 109.476 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -125.09 108.73 12.1 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.24 -0.913 . . . . 0.0 109.545 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.512 ' CB ' ' O ' ' A' ' 86' ' ' GLU . 83.8 t60 -168.69 142.47 3.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.314 -0.866 . . . . 0.0 109.489 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.414 ' OXT' ' O ' ' A' ' 90' ' ' HIS . 9.8 mm-40 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.511 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.52 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 8.2 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.423 0.63 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' GLU . . . . . 0.687 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 1.6 tp10 -60.14 -63.26 1.36 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.838 . . . . 0.0 109.598 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.697 ' CD1' HD23 ' A' ' 10' ' ' LEU . 3.3 mm? -75.88 -34.83 60.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.63 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.52 ' HB2' ' N ' ' B' ' 1' ' ' SER . 2.7 mm-40 -53.45 -61.98 1.95 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.236 -0.915 . . . . 0.0 109.63 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -60.73 -48.06 83.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.23 -0.919 . . . . 0.0 109.546 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -61.11 -14.13 22.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.278 -0.889 . . . . 0.0 109.664 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.545 ' SD ' HG12 ' A' ' 77' ' ' VAL . 1.6 mmt -83.05 -64.37 1.18 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 109.6 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.433 ' H ' HG23 ' B' ' 8' ' ' VAL . 3.2 t -51.35 -25.81 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -75.89 -57.84 3.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.207 -0.933 . . . . 0.0 109.6 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 0.491 HD13 HD11 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -49.26 -39.31 30.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.215 -0.928 . . . . 0.0 109.639 -179.867 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.495 HD12 ' O ' ' B' ' 7' ' ' MET . 4.8 mt -70.46 -35.53 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.209 -0.932 . . . . 0.0 109.665 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 2.6 t70 -69.58 -16.17 63.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 0.0 109.638 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.964 HG21 HD13 ' A' ' 3' ' ' LEU . 1.5 t -89.99 -37.99 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.457 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' SG ' ' B' ' 68' ' ' CYS . 46.1 t80 -66.95 -42.08 85.86 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.866 -1.147 . . . . 0.0 109.341 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' HIS . . . . . 0.602 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -78.85 -49.79 12.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.497 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 30.1 tt0 -53.98 -59.69 4.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.0 109.504 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.787 ' CG ' HD21 ' B' ' 35' ' ' LEU . 45.5 m-85 -60.43 -47.57 85.55 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.233 -0.917 . . . . 0.0 109.62 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.602 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 97.6 p -61.77 -14.98 37.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.193 -0.942 . . . . 0.0 109.589 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.26 -31.27 66.32 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' B' ' 17' ' ' TYR . 1.4 mtt-85 -77.33 -10.9 59.72 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -1.128 . . . . 0.0 109.404 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -79.66 170.02 17.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.67 -35.51 35.95 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.498 ' CB ' ' HD2' ' B' ' 26' ' ' LYS . 2.5 t0 -75.38 -24.05 57.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -1.119 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 23' ' ' ASP . 6.7 mttp 66.4 25.98 10.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.59 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' HIS . . . . . 0.533 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -160.69 22.93 0.14 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.558 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.533 ' CE ' ' HB3' ' B' ' 25' ' ' HIS . 0.1 OUTLIER -168.67 169.03 10.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.24 -0.913 . . . . 0.0 109.513 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.803 HD13 ' SG ' ' B' ' 68' ' ' CYS . 7.7 mp -122.36 138.73 54.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.883 . . . . 0.0 109.786 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.537 ' CD ' ' OE2' ' B' ' 31' ' ' GLU . 0.2 OUTLIER -89.77 169.02 11.63 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.028 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.6 mtmt -42.14 -26.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.037 -1.04 . . . . 0.0 109.854 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.451 ' N ' ' O ' ' B' ' 28' ' ' LYS . 36.3 t -77.88 -51.92 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 110.97 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.609 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -58.16 -38.58 76.88 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.76 -1.212 . . . . 0.0 109.026 -179.377 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.957 HD22 ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -58.8 -67.28 0.38 Allowed 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.469 -0.769 . . . . 0.0 108.94 179.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HD3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.08 -30.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.3 OUTLIER -63.75 -64.29 0.93 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.303 179.843 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.787 HD21 ' CG ' ' B' ' 17' ' ' TYR . 4.2 mm? -46.01 -40.32 10.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.33 -0.856 . . . . 0.0 109.65 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.878 HG21 ' CG2' ' B' ' 53' ' ' VAL . 1.7 mp -62.18 -41.82 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.068 -1.02 . . . . 0.0 109.945 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -82.14 -73.81 0.37 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.033 -1.042 . . . . 0.0 111.394 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' ASN . . . . . 0.426 ' C ' ' ND2' ' B' ' 38' ' ' ASN . 0.1 OUTLIER -68.18 -1.15 5.52 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.032 -1.043 . . . . 0.0 111.465 -178.071 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.562 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -131.03 -9.68 3.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.7 -1.25 . . . . 0.0 110.313 -179.92 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.768 HD11 ' HE3' ' A' ' 7' ' ' MET . 1.6 tp -141.48 78.3 1.63 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.705 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 41' ' ' SER . . . . . 0.427 ' O ' ' O ' ' B' ' 42' ' ' HIS . 0.1 OUTLIER -123.12 -19.89 5.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.151 -0.968 . . . . 0.0 109.739 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 42' ' ' HIS . . . . . 0.55 ' CE1' ' OE2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER -47.68 -92.09 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.136 -0.977 . . . . 0.0 109.297 -179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -89.6 12.29 17.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.188 -0.945 . . . . 0.0 109.183 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.898 HD11 ' O ' ' B' ' 80' ' ' VAL . 4.2 mm? -92.81 -36.35 12.91 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.341 -0.849 . . . . 0.0 109.451 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 44' ' ' LEU . 49.4 mt-10 60.67 147.41 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' B' ' 48' ' ' LYS . 1.1 mm-40 -43.91 139.04 2.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.243 -0.911 . . . . 0.0 109.45 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.702 ' CD1' HG21 ' B' ' 53' ' ' VAL . 2.0 mt -43.86 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.334 -0.854 . . . . 0.0 109.12 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.472 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER -42.47 -31.85 0.48 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.753 -179.747 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.472 ' CG ' ' O ' ' B' ' 48' ' ' LYS . 0.9 OUTLIER 171.39 65.27 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.216 -0.928 . . . . 0.0 109.405 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 47.97 48.35 18.07 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.931 . . . . 0.0 109.193 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.449 ' OE1' ' HG3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.05 -64.1 1.19 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.795 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 1.022 ' CG1' HG13 ' B' ' 80' ' ' VAL . 1.3 t -90.83 -20.9 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.19 -0.944 . . . . 0.0 109.692 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HD3' ' B' ' 33' ' ' LYS . 37.6 t -82.92 -31.35 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 120.803 -1.185 . . . . 0.0 108.993 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.54 -27.67 19.01 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.287 -0.883 . . . . 0.0 109.15 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -86.51 -46.09 10.49 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.333 -0.855 . . . . 0.0 109.447 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 1.134 HG22 HD21 ' B' ' 60' ' ' LEU . 1.2 p -63.52 -41.41 92.56 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.037 -1.04 . . . . 0.0 108.904 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.552 ' CE ' HD13 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.49 -49.25 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.852 -0.53 . . . . 0.0 109.658 179.784 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -61.7 -44.85 96.14 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.453 ' C ' HD23 ' B' ' 60' ' ' LEU . 34.2 m -65.74 -13.74 59.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.436 -0.79 . . . . 0.0 109.793 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 1.134 HD21 HG22 ' B' ' 56' ' ' VAL . 2.4 mt -87.17 -44.94 11.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.037 -1.039 . . . . 0.0 109.169 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' B' ' 57' ' ' MET . 8.3 m-20 -42.75 112.35 0.35 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.605 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -44.44 -45.58 9.16 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.31 -0.869 . . . . 0.0 109.611 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -155.18 19.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.169 -0.957 . . . . 0.0 109.762 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.13 95.5 2.28 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 t0 179.8 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.275 -1.132 . . . . 0.0 108.442 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 -21.21 28.94 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' B' ' 26' ' ' LYS . 5.3 mm-40 -69.88 108.1 3.84 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.233 -1.157 . . . . 0.0 109.29 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.803 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.4 OUTLIER -69.69 128.1 35.26 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.215 -0.928 . . . . 0.0 109.727 -179.548 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.512 ' N ' ' OE1' ' B' ' 72' ' ' GLU . 9.1 m-20 -100.55 170.3 8.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.27 -0.894 . . . . 0.0 108.649 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.41 ' CD1' HG21 ' A' ' 82' ' ' THR . 0.8 OUTLIER -60.29 -59.37 5.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.757 -1.214 . . . . 0.0 110.148 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.523 ' HA ' ' HG2' ' B' ' 74' ' ' MET . 2.4 mt-30 -52.44 -24.69 8.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.046 -1.034 . . . . 0.0 109.084 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' B' ' 60' ' ' LEU . 0.1 OUTLIER -76.95 -38.15 53.85 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.349 -0.845 . . . . 0.0 109.389 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.549 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 24.7 t80 -68.46 -48.79 63.6 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.197 -0.939 . . . . 0.0 109.092 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.7 ' HB3' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -54.24 -46.48 72.58 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.307 -0.87 . . . . 0.0 109.337 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.505 ' N ' ' SD ' ' B' ' 74' ' ' MET . . . -74.73 -20.1 59.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.165 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.774 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.4 OUTLIER -72.73 -71.11 0.31 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 109.233 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.642 HG21 ' CD2' ' A' ' 3' ' ' LEU . 53.1 t -57.54 -31.29 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.111 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.539 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -59.76 -42.06 92.41 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.338 -0.851 . . . . 0.0 109.227 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.9 mmm -73.63 -70.06 0.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 0.0 109.618 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 1.022 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.32 -25.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 120.891 -1.13 . . . . 0.0 109.591 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.42 ' N ' ' O ' ' B' ' 79' ' ' MET . 11.8 m -70.96 -67.74 0.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.973 -1.079 . . . . 0.0 108.885 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.585 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 0.9 OUTLIER -82.98 -52.95 6.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.057 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.09 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.261 0.553 . . . . 0.0 109.881 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' B' ' 82' ' ' THR . 41.4 t -72.78 -52.69 13.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.565 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -9.91 50.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.266 -0.896 . . . . 0.0 109.583 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -81.85 -20.15 39.55 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.24 -0.912 . . . . 0.0 109.48 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.472 ' O ' ' HG3' ' B' ' 89' ' ' GLU . 0.2 OUTLIER -58.83 -38.24 78.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.489 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.46 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 0.2 OUTLIER -54.84 -33.41 61.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' B' ' 87' ' ' PHE . 3.4 mt-10 73.54 91.98 0.08 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.294 -0.879 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 90' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 89' ' ' GLU . 2.1 m80 55.37 169.77 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.46 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 118.0 -1.0 . . . . 0.0 109.453 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.508 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 1.013 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 3.0 tt0 -64.32 -50.41 67.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.896 . . . . 0.0 109.468 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.678 HD21 HG11 ' B' ' 13' ' ' VAL . 1.2 mp -79.94 -27.5 39.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.57 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' B' ' 39' ' ' GLU . 37.7 tt0 -60.99 -50.54 72.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 109.525 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -52.88 15.62 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.297 -0.877 . . . . 0.0 109.251 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.747 ' HB1' HD23 ' B' ' 10' ' ' LEU . . . -61.9 -13.26 23.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.926 . . . . 0.0 109.504 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.524 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 42.3 ttp -80.09 -59.08 2.85 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.219 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 75.9 t -57.09 -24.51 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.224 -0.923 . . . . 0.0 109.266 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.11 -51.82 9.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.61 HD23 HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -57.53 -60.66 3.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 109.426 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.669 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 6.9 mt -53.06 -43.97 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.274 -0.891 . . . . 0.0 109.227 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 9.3 m-20 -54.16 -37.18 64.16 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.375 -0.828 . . . . 0.0 109.247 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.821 HG22 ' CE1' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -66.29 -39.77 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.18 -0.95 . . . . 0.0 109.188 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -53.74 -62.85 1.38 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.985 -1.072 . . . . 0.0 108.286 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -66.19 -10.04 37.61 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.291 -0.881 . . . . 0.0 109.13 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 13' ' ' VAL . 1.7 tp60 -67.26 -66.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 109.91 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 1.006 ' CE2' HD22 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -125.05 35.35 4.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.697 -1.252 . . . . 0.0 110.708 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.781 ' OG ' HD21 ' A' ' 27' ' ' LEU . 37.6 m -91.4 -22.36 20.51 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.922 -1.111 . . . . 0.0 109.201 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.507 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -103.36 20.72 41.6 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -60.42 -61.91 2.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -1.132 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -122.87 164.83 17.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.431 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.39 -128.62 11.63 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.565 ' HB2' ' CE1' ' A' ' 25' ' ' HIS . 3.9 m-20 -88.99 -148.81 0.18 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -1.144 . . . . 0.0 109.46 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 14.9 ttpt -145.04 65.81 1.26 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 109.476 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CE1' ' HB2' ' A' ' 23' ' ' ASP . 2.8 p80 -170.33 -34.22 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.227 -0.921 . . . . 0.0 109.969 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.538 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -125.46 170.4 11.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.135 -0.978 . . . . 0.0 110.006 -179.524 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 ' OG ' ' A' ' 18' ' ' SER . 8.1 mt -104.19 170.52 7.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.425 -0.797 . . . . 0.0 109.929 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -133.54 69.89 1.47 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.317 -0.864 . . . . 0.0 109.667 179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 65.21 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.59 -0.694 . . . . 0.0 111.064 179.121 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 m -46.14 -42.32 13.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 110.594 -178.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.832 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.8 mm-40 -59.86 -40.31 88.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.932 -1.105 . . . . 0.0 108.919 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.747 ' CD2' HD13 ' A' ' 60' ' ' LEU . 1.5 mp -55.76 -60.18 3.81 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.637 ' CG ' HG11 ' A' ' 53' ' ' VAL . 9.1 mttt -41.56 -50.97 4.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.237 -0.914 . . . . 0.0 109.93 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 38' ' ' ASN . 0.2 OUTLIER -60.23 -39.42 86.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.998 -1.064 . . . . 0.0 110.126 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.006 HD22 ' CE2' ' A' ' 17' ' ' TYR . 3.8 mm? -52.71 -56.58 14.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.463 -0.773 . . . . 0.0 110.263 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 1.056 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mp -94.29 -57.02 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 120.93 -1.106 . . . . 0.0 109.788 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.95 ' ND2' HD11 ' A' ' 47' ' ' ILE . 1.6 m120 -43.96 -26.19 0.26 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.162 -0.961 . . . . 0.0 109.565 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 34' ' ' GLU . 5.4 t30 -99.82 -41.91 7.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.151 -0.968 . . . . 0.0 109.627 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 58.0 mm-40 -72.05 -62.78 1.31 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.056 HD13 HG23 ' A' ' 36' ' ' ILE . 5.9 mp -41.71 -65.74 0.42 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.394 -0.817 . . . . 0.0 109.57 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 t 51.21 21.54 1.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.447 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 8.5 t60 -153.01 -73.98 0.13 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.272 -0.893 . . . . 0.0 109.515 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.467 ' CE2' HG23 ' A' ' 81' ' ' THR . 0.1 OUTLIER -44.11 -26.5 0.3 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.23 -0.919 . . . . 0.0 109.499 -179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.855 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.9 OUTLIER -167.52 76.82 0.16 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -44.02 111.58 0.31 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.225 -0.922 . . . . 0.0 109.418 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.66 ' O ' HD13 ' A' ' 47' ' ' ILE . 35.0 mt-10 60.93 -164.13 0.24 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.882 . . . . 0.0 109.381 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 1.0 HG13 HG21 ' A' ' 53' ' ' VAL . 45.0 mm -127.66 74.26 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.197 -0.939 . . . . 0.0 109.563 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -42.8 -44.09 4.28 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.417 -0.802 . . . . 0.0 109.342 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.66 ' O ' HG22 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -127.47 153.13 46.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.379 -0.826 . . . . 0.0 109.126 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 1.6 pt20 -85.76 55.55 3.57 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.28 -0.888 . . . . 0.0 109.413 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.52 -45.6 8.84 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 109.954 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.859 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -98.66 -25.78 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.035 . . . . 0.0 110.076 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.0 HG21 HG13 ' A' ' 47' ' ' ILE . 52.0 t -81.92 -24.73 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.812 -1.18 . . . . 0.0 109.354 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -90.23 -37.06 14.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.167 -0.958 . . . . 0.0 108.916 179.247 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -78.26 -47.39 18.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.426 -0.796 . . . . 0.0 109.268 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.687 HG13 HD12 ' A' ' 60' ' ' LEU . 2.9 p -59.12 -44.33 91.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.519 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 10.7 tpt -41.8 -48.76 4.36 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.603 -0.686 . . . . 0.0 109.949 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -57.16 -56.35 22.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.183 -0.948 . . . . 0.0 109.422 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 59' ' ' THR . 7.8 m -66.54 -8.67 28.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.306 -0.871 . . . . 0.0 109.574 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.813 HD22 ' OE1' ' A' ' 72' ' ' GLU . 63.7 mt -96.15 -17.29 20.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 -179.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 62' ' ' ASN . 8.9 m-20 -59.1 113.37 2.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.167 -0.958 . . . . 0.0 109.393 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' OD1' ' OD2' ' A' ' 69' ' ' ASP . 14.5 t30 -43.5 -47.75 7.25 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 109.535 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -165.84 40.86 0.06 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.41 87.8 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.7 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.311 -1.111 . . . . 0.0 108.632 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 -19.22 27.56 Favored Glycine 0 N--CA 1.485 1.94 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 1.3 mt-10 -71.79 103.2 3.04 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -1.149 . . . . 0.0 109.41 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' CYS . . . . . 0.541 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -70.05 137.02 50.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.303 -0.873 . . . . 0.0 109.258 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 6.5 m-20 -116.85 170.56 8.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.416 -0.803 . . . . 0.0 109.163 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.669 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -52.08 -50.42 61.59 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.056 -1.028 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.562 ' O ' ' HE3' ' A' ' 74' ' ' MET . 0.0 OUTLIER -48.49 -35.73 13.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 109.155 -179.716 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.813 ' OE1' HD22 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.53 -31.84 47.72 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.969 -1.082 . . . . 0.0 109.369 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -53.55 -51.48 62.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.977 -1.077 . . . . 0.0 108.966 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.807 ' HE3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -67.13 -38.36 85.42 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.401 -0.812 . . . . 0.0 109.353 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.807 ' HB2' ' HE3' ' A' ' 74' ' ' MET . . . -68.47 -15.76 63.66 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.081 -1.012 . . . . 0.0 108.866 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.63 ' O ' HG23 ' A' ' 80' ' ' VAL . 1.0 OUTLIER -82.7 -72.29 0.45 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.388 -0.82 . . . . 0.0 109.216 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.567 ' CG2' HD23 ' B' ' 3' ' ' LEU . 54.1 t -54.28 -32.92 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 O-C-N 121.226 -0.921 . . . . 0.0 108.921 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -65.38 -42.02 93.14 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.508 -0.745 . . . . 0.0 109.849 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.721 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 41.6 mmm -77.53 -71.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.914 -1.116 . . . . 0.0 110.089 -179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.859 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -45.07 -23.14 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 O-C-N 120.436 -1.415 . . . . 0.0 109.83 -178.682 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.612 HG21 HD11 ' B' ' 11' ' ' ILE . 18.5 m -80.77 -66.28 0.9 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.816 -1.178 . . . . 0.0 108.643 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.75 -50.2 10.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 108.596 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.38 -41.51 0.64 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.758 -0.589 . . . . 0.0 109.739 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 16.4 t -63.78 -49.51 72.66 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.262 -0.899 . . . . 0.0 109.598 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.51 -21.67 64.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.522 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -90.04 -21.98 22.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -67.3 0.26 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.53 ' O ' ' CG ' ' A' ' 89' ' ' GLU . 38.7 m-85 -57.56 -69.37 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.253 -0.904 . . . . 0.0 109.471 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.53 ' CG ' ' O ' ' A' ' 88' ' ' PHE . 10.9 pt-20 41.84 29.14 0.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.487 -0.758 . . . . 0.0 109.642 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' N ' ' O ' ' A' ' 88' ' ' PHE . 11.5 m-70 -76.19 153.47 36.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.452 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.409 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -76.34 0.09 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 0.0 109.49 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.61 HD11 HD23 ' A' ' 10' ' ' LEU . 2.8 mp -62.48 -15.75 51.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.918 . . . . 0.0 109.431 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.438 ' O ' HG23 ' B' ' 8' ' ' VAL . 1.6 tp10 -73.01 -69.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -58.97 -49.57 77.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 109.322 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' B' ' 7' ' ' MET . . . -54.89 -56.42 19.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.325 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' MET . . . . . 0.523 ' CB ' ' O ' ' B' ' 3' ' ' LEU . 15.5 ttp -43.83 -39.0 3.59 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.385 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 4' ' ' GLU . 87.0 t -61.28 -48.86 87.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.425 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ALA . . . . . 1.013 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -62.02 -61.48 2.45 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.565 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' LEU . . . . . 1.006 HD12 ' CZ ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -43.43 -39.12 3.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.312 -0.867 . . . . 0.0 109.489 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.801 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 13.5 mm -61.66 -51.51 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.128 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 6.9 t0 -58.95 -17.06 21.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.321 -0.862 . . . . 0.0 109.229 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.759 HG13 ' CD2' ' B' ' 35' ' ' LEU . 1.3 t -76.5 -53.18 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.286 -0.884 . . . . 0.0 109.166 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.8 t80 -55.1 -50.98 67.84 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.812 -1.18 . . . . 0.0 109.384 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -63.84 1.0 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.166 -0.959 . . . . 0.0 109.93 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.447 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 0.9 OUTLIER -45.31 -68.73 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.806 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.637 ' HE2' HG22 ' B' ' 13' ' ' VAL . 23.4 m-85 -42.73 -34.12 0.86 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.384 -0.822 . . . . 0.0 109.722 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' SER . . . . . 0.536 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -85.69 50.0 1.88 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.19 -0.944 . . . . 0.0 109.294 179.762 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.61 -44.3 1.7 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -23.06 21.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.326 -1.103 . . . . 0.0 109.456 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER -69.84 102.47 1.95 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.213 -0.929 . . . . 0.0 109.504 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . 44.1 -95.84 0.01 OUTLIER Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' B' ' 21' ' ' GLU . 0.4 OUTLIER -112.49 -81.23 0.59 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -1.157 . . . . 0.0 109.411 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 24' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' B' ' 18' ' ' SER . 0.1 OUTLIER 175.77 56.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.261 -0.899 . . . . 0.0 109.378 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -136.88 6.63 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.189 -0.944 . . . . 0.0 109.7 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.554 ' O ' HD23 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -170.1 170.53 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.126 -0.984 . . . . 0.0 109.689 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.873 HD13 HD11 ' B' ' 35' ' ' LEU . 26.1 mt -126.54 130.74 51.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.235 -0.915 . . . . 0.0 110.122 -179.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' C ' ' B' ' 29' ' ' LYS . 3.2 ttmt -69.67 154.03 42.57 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.809 ' HA ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.45 -32.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.314 -0.866 . . . . 0.0 109.718 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.8 OUTLIER -76.31 -46.58 27.09 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.322 -0.861 . . . . 0.0 109.481 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.732 ' O ' HD12 ' B' ' 35' ' ' LEU . 0.4 OUTLIER -52.67 -42.96 65.21 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.179 -0.951 . . . . 0.0 108.988 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.825 HD21 ' CB ' ' B' ' 68' ' ' CYS . 5.6 mt -60.3 -66.32 0.54 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.648 -0.657 . . . . 0.0 109.306 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.629 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.6 OUTLIER -42.88 -27.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 109.364 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -66.53 -51.59 54.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -0.873 . . . . 0.0 109.329 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.873 HD11 HD13 ' B' ' 27' ' ' LEU . 2.3 mp -56.77 -42.12 78.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.263 -0.898 . . . . 0.0 109.475 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.546 HG23 ' HB2' ' B' ' 40' ' ' LEU . 3.4 mt -79.91 -14.13 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.268 -0.895 . . . . 0.0 109.563 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -89.38 -14.73 34.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 109.533 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -99.69 -35.43 9.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 0.0 109.507 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.555 ' OE1' HD12 ' B' ' 40' ' ' LEU . 3.2 tm-20 -110.31 -10.01 14.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.505 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' B' ' 81' ' ' THR . 0.3 OUTLIER -131.6 68.08 1.5 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.233 -0.917 . . . . 0.0 109.58 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.99 -9.99 13.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.09 -44.28 2.92 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.902 . . . . 0.0 109.465 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.24 -47.94 46.09 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.251 -0.906 . . . . 0.0 109.404 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.751 HD13 HD13 ' B' ' 47' ' ' ILE . 0.4 OUTLIER -117.11 40.66 2.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.904 . . . . 0.0 109.353 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 45.44 -150.07 0.07 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.214 -0.929 . . . . 0.0 109.431 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -85.22 45.04 1.14 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.399 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' ILE . . . . . 0.751 HD13 HD13 ' B' ' 44' ' ' LEU . 9.0 mm 60.99 20.85 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.295 -0.878 . . . . 0.0 109.568 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.4 mttt 43.81 32.68 0.62 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.124 -0.985 . . . . 0.0 109.382 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 50.8 tt0 83.14 -43.1 0.11 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.63 -0.668 . . . . 0.0 109.878 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.506 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.2 OUTLIER 176.22 56.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.0 109.645 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -90.55 -69.7 0.71 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -0.932 . . . . 0.0 109.529 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.952 ' CG1' HG13 ' B' ' 80' ' ' VAL . 17.0 t -85.56 -22.22 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.196 -0.94 . . . . 0.0 109.688 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.657 ' CG2' HG21 ' B' ' 47' ' ' ILE . 47.8 t -78.86 -36.02 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.147 -0.97 . . . . 0.0 109.366 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.506 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 23.7 t70 -76.58 -35.66 58.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.252 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -73.53 -45.68 52.22 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.879 . . . . 0.0 109.385 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' VAL . . . . . 1.059 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 25.9 m -59.77 -43.36 91.5 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.147 -0.97 . . . . 0.0 109.69 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 57' ' ' MET . . . . . 0.496 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -41.62 -28.11 0.12 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.972 -1.08 . . . . 0.0 109.419 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.6 tm-20 -83.63 -46.25 12.55 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' THR . . . . . 0.477 ' O ' ' C ' ' B' ' 60' ' ' LEU . 7.5 m -68.76 -65.12 0.74 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 109.054 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' LEU . . . . . 0.644 HD13 ' CD2' ' B' ' 76' ' ' PHE . 21.0 mt -36.44 -62.58 0.45 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.81 -0.556 . . . . 0.0 109.693 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' HA2' ' B' ' 64' ' ' GLY . 5.1 t70 -56.62 98.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.402 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.456 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 4.6 m-80 -96.33 -11.17 26.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -105.45 -40.67 5.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -0.922 . . . . 0.0 109.479 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.46 ' HA2' ' OD1' ' B' ' 61' ' ' ASP . . . 101.82 95.39 2.26 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 176.71 -32.48 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.211 -1.17 . . . . 0.0 108.61 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 12.82 16.85 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' GLU . . . . . 0.523 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 20.0 pt-20 -110.39 116.51 31.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.24 -1.153 . . . . 0.0 109.337 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' CYS . . . . . 0.825 ' CB ' HD21 ' B' ' 32' ' ' LEU . 9.0 t -73.04 152.77 41.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.2 -0.937 . . . . 0.0 109.765 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.463 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -115.38 171.8 7.48 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.801 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 1.0 OUTLIER -55.34 -51.46 66.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.123 -0.986 . . . . 0.0 110.305 -179.669 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 71' ' ' GLN . . . . . 0.476 ' OE1' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -59.98 -36.33 76.93 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.314 -0.867 . . . . 0.0 108.975 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.476 ' HG2' ' OE1' ' B' ' 71' ' ' GLN . 3.4 mt-10 -79.82 -13.12 59.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.091 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 1.006 ' CZ ' HD12 ' B' ' 10' ' ' LEU . 0.0 OUTLIER -73.88 -60.35 2.3 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.654 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 74' ' ' MET . . . . . 0.567 ' SD ' ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -67.78 -24.43 65.32 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.524 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -70.14 -30.54 67.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.301 -0.874 . . . . 0.0 108.731 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 1.059 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.8 OUTLIER -75.71 -69.02 0.51 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.226 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD22 ' A' ' 3' ' ' LEU . 42.9 t -49.22 -36.12 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.321 -0.862 . . . . 0.0 109.408 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.54 ' CB ' ' HG2' ' A' ' 74' ' ' MET . . . -66.17 -38.39 87.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.873 . . . . 0.0 110.438 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.73 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 58.5 mtm -78.2 -71.35 0.43 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.888 -1.133 . . . . 0.0 109.795 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 80' ' ' VAL . . . . . 0.952 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -45.41 -23.49 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 O-C-N 120.452 -1.405 . . . . 0.0 109.585 -179.13 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 81' ' ' THR . . . . . 0.952 ' HA ' HD21 ' B' ' 40' ' ' LEU . 11.8 m -79.09 -67.27 0.77 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.926 -1.109 . . . . 0.0 108.678 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' THR . . . . . 0.58 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.2 t -80.71 -50.74 9.5 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.206 -0.934 . . . . 0.0 108.615 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.73 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.01 -31.21 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.331 0.586 . . . . 0.0 109.657 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 84' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' B' ' 82' ' ' THR . 48.2 t -85.25 -43.59 13.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 0.0 109.516 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' B' ' 82' ' ' THR . 54.4 t-80 -48.07 -33.51 8.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.523 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' B' ' 87' ' ' PHE . 2.0 tt0 -87.97 -28.36 21.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.525 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' B' ' 84' ' ' CYS . 0.2 OUTLIER -44.05 -50.58 8.36 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -52.37 -67.51 0.25 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.223 -0.923 . . . . 0.0 109.405 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 176.34 4.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.93 136.74 17.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.275 -0.89 . . . . 0.0 109.497 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.416 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' B' ' 39' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.685 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -71.88 -59.92 2.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.446 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -72.31 -23.96 61.25 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.455 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.44 ' HB3' ' N ' ' A' ' 1' ' ' SER . 10.6 tm-20 -62.77 -61.25 2.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -41.9 94.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.226 -0.921 . . . . 0.0 109.326 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.89 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -66.91 -19.07 65.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.264 -0.898 . . . . 0.0 109.42 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.66 ' O ' HD12 ' A' ' 11' ' ' ILE . 2.2 mtp -76.32 -44.13 38.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.401 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 8' ' ' VAL . 3.5 t -65.94 -38.18 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.501 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -75.04 -65.67 0.85 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.481 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.983 HD11 ' HB1' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -43.76 -41.24 4.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.448 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.66 HD12 ' O ' ' A' ' 7' ' ' MET . 61.9 mt -62.19 -45.23 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -56.99 -27.37 61.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.227 -0.921 . . . . 0.0 109.357 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.037 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -80.01 -28.7 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.266 -0.897 . . . . 0.0 109.068 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 34.4 t80 -66.33 -45.69 79.4 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.055 -1.028 . . . . 0.0 109.45 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 8.1 m-70 -80.32 -34.55 36.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.597 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.14 -63.38 1.26 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.494 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.501 ' HE1' HG22 ' A' ' 13' ' ' VAL . 43.8 m-85 -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.543 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 82.9 p -61.18 -21.09 63.48 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.288 -0.883 . . . . 0.0 109.486 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.482 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -66.73 -31.99 80.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.3 mmt180 -52.51 -41.56 63.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -1.132 . . . . 0.0 109.477 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 23' ' ' ASP . 43.6 tt0 -76.6 81.89 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.451 ' O ' ' O ' ' A' ' 23' ' ' ASP . . . 43.63 -95.23 0.01 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -57.91 -158.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -1.133 . . . . 0.0 109.448 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.8 pttp -153.93 89.79 1.33 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 109.412 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.564 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -169.05 -36.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.543 ' N ' ' HB2' ' A' ' 18' ' ' SER . 0.0 OUTLIER -122.74 170.11 10.39 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 109.557 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.872 HD23 ' C ' ' A' ' 31' ' ' GLU . 2.9 mp -110.4 143.65 40.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.274 -0.891 . . . . 0.0 109.503 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 30' ' ' SER . 1.5 tttp -98.56 84.64 3.2 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.301 -0.875 . . . . 0.0 109.282 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' A' ' 30' ' ' SER . 29.1 ttmt 43.17 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.425 -0.797 . . . . 0.0 110.847 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' A' ' 28' ' ' LYS . 2.0 t -47.61 -31.89 4.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.156 -0.965 . . . . 0.0 110.06 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.872 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -58.85 -45.62 89.63 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.832 -1.168 . . . . 0.0 108.64 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.933 HD11 ' SG ' ' A' ' 68' ' ' CYS . 27.1 mt -58.65 -54.95 41.25 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' HG21 ' A' ' 53' ' ' VAL . 1.2 tttt -46.31 -42.46 14.69 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.386 -0.821 . . . . 0.0 109.391 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -58.47 7.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.037 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.23 -40.25 58.4 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.335 -0.853 . . . . 0.0 109.663 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.628 HD13 HG22 ' A' ' 53' ' ' VAL . 48.0 mt -61.75 -36.33 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.203 -0.936 . . . . 0.0 109.951 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLU . 6.8 m120 -94.92 -71.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.085 -1.01 . . . . 0.0 109.779 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 37' ' ' ASN . 2.6 t-20 -41.53 -27.08 0.08 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.421 -0.799 . . . . 0.0 110.111 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.978 ' HG3' HD23 ' A' ' 35' ' ' LEU . 1.6 mm-40 -112.03 -46.14 3.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.09 -1.006 . . . . 0.0 109.726 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 9.3 mp -106.9 61.97 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.103 -0.998 . . . . 0.0 109.582 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.218 -0.926 . . . . 0.0 109.409 179.886 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.578 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 1.1 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.568 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 12.5 mttt 83.59 -44.58 0.11 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.553 -0.717 . . . . 0.0 109.367 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 60.9 mm-40 -110.32 14.69 22.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.238 -0.914 . . . . 0.0 109.03 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.536 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.4 mt-30 78.34 59.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.711 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 3.7 mp0 -90.08 -70.6 0.66 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.215 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.837 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t -91.44 -21.18 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.126 -0.984 . . . . 0.0 108.629 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.628 HG22 HD13 ' A' ' 36' ' ' ILE . 55.2 t -73.22 -30.73 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.368 -0.832 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -90.09 -40.42 12.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.405 -0.809 . . . . 0.0 109.113 179.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -64.41 -35.5 81.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.326 -0.859 . . . . 0.0 109.272 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.837 HG13 ' O ' ' A' ' 52' ' ' VAL . 4.4 m -55.38 -56.54 11.17 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.263 -0.898 . . . . 0.0 109.716 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.645 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -41.49 -28.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.001 -1.062 . . . . 0.0 109.626 -179.768 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.1 tp10 -69.59 -55.99 8.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.285 -0.884 . . . . 0.0 108.788 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.468 ' O ' ' C ' ' A' ' 60' ' ' LEU . 9.6 m -81.28 -61.68 1.88 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 108.877 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.721 HD13 ' HB ' ' A' ' 56' ' ' VAL . 6.5 mp -37.82 -36.43 0.19 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.695 -0.628 . . . . 0.0 109.79 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 57' ' ' MET . 28.0 t0 -89.98 95.73 10.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.213 -0.93 . . . . 0.0 109.433 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -109.69 11.23 24.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.248 -0.908 . . . . 0.0 109.498 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -120.97 -30.21 4.44 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.518 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.33 90.77 0.56 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.87 -32.47 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.271 -1.135 . . . . 0.0 108.618 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.2 31.15 Favored Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.471 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 21.9 mt-10 -88.25 107.12 18.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -1.166 . . . . 0.0 109.402 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.933 ' SG ' HD11 ' A' ' 32' ' ' LEU . 4.3 m -69.82 143.58 52.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.256 -0.902 . . . . 0.0 109.797 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.0 m-20 -116.62 169.5 9.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.492 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -51.0 -47.48 61.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.233 -0.917 . . . . 0.0 110.072 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.577 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 16.6 mt-30 -47.92 -42.09 26.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.44 -0.787 . . . . 0.0 109.582 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.57 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.03 -25.02 43.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.163 -0.961 . . . . 0.0 109.979 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.457 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 10.4 t80 -59.3 -58.32 9.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.069 -1.019 . . . . 0.0 109.407 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.921 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -68.36 -49.73 58.15 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.233 -0.917 . . . . 0.0 109.46 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB3' ' A' ' 78' ' ' ALA . . . -54.96 -23.47 19.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.117 -0.99 . . . . 0.0 108.973 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.815 ' CE1' HG21 ' A' ' 80' ' ' VAL . 2.2 t80 -70.3 -63.67 1.04 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HG23 ' A' ' 80' ' ' VAL . 3.3 t -52.91 -23.57 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' B' ' 74' ' ' MET . . . -62.33 -54.23 43.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.421 -0.799 . . . . 0.0 108.865 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 1.4 mmm -70.52 -69.44 0.36 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.379 -0.825 . . . . 0.0 109.479 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.815 HG21 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.03 -25.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 120.567 -1.333 . . . . 0.0 110.129 -179.416 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.2 m -76.36 -69.98 0.47 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.919 -1.113 . . . . 0.0 108.512 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.572 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.6 t -78.04 -49.91 13.09 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.95 -47.75 1.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 9.2 t -61.27 -47.12 87.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.471 -0.768 . . . . 0.0 109.286 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -9.93 51.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.25 -0.906 . . . . 0.0 109.488 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 87' ' ' PHE . 0.8 OUTLIER -82.68 -21.06 35.05 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.313 -0.867 . . . . 0.0 109.498 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 O-C-N 121.25 -0.906 . . . . 0.0 109.486 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.532 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 3' ' ' LEU . 1.3 tp10 -70.38 -55.35 9.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.719 HD21 HG11 ' A' ' 13' ' ' VAL . 3.1 mm? -75.44 -27.64 59.02 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 0.0 109.39 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.532 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 2.8 tm-20 -67.15 -61.55 1.87 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.82 -49.3 71.37 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.92 . . . . 0.0 109.41 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.983 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -65.02 -22.59 67.02 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.289 -0.882 . . . . 0.0 109.453 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.48 ' HG2' HD12 ' B' ' 11' ' ' ILE . 5.3 ttt -68.95 -42.61 76.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.427 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.8 t -70.34 -34.16 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.217 -0.927 . . . . 0.0 109.433 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.685 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -65.73 -64.46 0.86 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.243 -0.911 . . . . 0.0 109.472 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.804 HD22 ' SD ' ' B' ' 74' ' ' MET . 0.4 OUTLIER -50.74 -47.94 59.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.473 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 88.7 mt -56.42 -36.0 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.179 -0.951 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.7 OUTLIER -67.6 -29.85 69.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.244 -0.91 . . . . 0.0 109.439 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 1.072 HG13 HD11 ' B' ' 35' ' ' LEU . 10.8 t -75.72 -25.02 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.4 t80 -74.69 -50.95 15.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.996 -1.065 . . . . 0.0 109.478 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.446 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 15.6 m80 -78.28 -20.82 50.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.25 -0.906 . . . . 0.0 109.832 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 53.3 tt0 -83.13 -60.29 2.2 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.139 -0.976 . . . . 0.0 109.565 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.648 ' CD2' HD13 ' B' ' 35' ' ' LEU . 28.0 m-85 -63.32 -28.18 69.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.889 . . . . 0.0 109.541 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' B' ' 25' ' ' HIS . 84.6 p -71.09 -20.48 62.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.189 -0.945 . . . . 0.0 109.69 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.96 30.28 10.71 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.14 -59.49 2.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -1.144 . . . . 0.0 109.529 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 22' ' ' GLY . 0.2 OUTLIER -114.74 97.54 6.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.9 . . . . 0.0 109.513 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 49.78 -179.85 0.02 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' B' ' 22' ' ' GLY . 81.0 m-20 52.06 174.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -1.162 . . . . 0.0 109.452 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -172.44 59.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.24 -0.912 . . . . 0.0 109.511 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.523 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -169.2 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.275 -0.891 . . . . 0.0 109.542 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.488 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 1.4 mptt -122.97 160.75 25.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 109.54 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.763 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.8 mp -109.27 132.29 54.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.928 . . . . 0.0 109.584 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -79.73 170.12 16.98 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -45.82 -25.01 0.45 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.879 -1.138 . . . . 0.0 109.324 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.509 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 0.2 OUTLIER -82.28 -50.54 8.84 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.646 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.763 ' C ' HD23 ' B' ' 27' ' ' LEU . 43.0 mt-10 -56.68 -38.65 72.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.13 . . . . 0.0 109.402 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.873 HD22 HD23 ' B' ' 60' ' ' LEU . 16.0 mt -65.02 -57.44 8.68 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.594 -0.691 . . . . 0.0 109.293 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 1.13 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -42.27 -50.29 4.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.339 -0.851 . . . . 0.0 109.497 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -51.58 -61.62 2.13 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.188 -0.945 . . . . 0.0 109.151 179.736 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 1.072 HD11 HG13 ' B' ' 13' ' ' VAL . 1.1 tp -43.47 -38.1 2.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.311 -0.868 . . . . 0.0 109.43 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 1.045 HG13 HG22 ' B' ' 53' ' ' VAL . 3.0 mm -57.18 -49.93 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.229 -0.919 . . . . 0.0 109.586 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' B' ' 39' ' ' GLU . 51.1 m-80 -93.01 -65.35 1.0 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 109.807 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' B' ' 37' ' ' ASN . 0.6 OUTLIER -41.14 -26.92 0.06 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.412 -0.805 . . . . 0.0 110.265 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 3.9 mm-40 -118.73 -40.54 2.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.987 -1.071 . . . . 0.0 109.986 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 5.3 mp -108.14 67.11 0.66 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.094 -1.004 . . . . 0.0 109.596 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 28.1 t . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 109.417 179.879 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.72 HD12 ' CG2' ' B' ' 53' ' ' VAL . 10.5 mm . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.1 mmtp -111.28 55.33 0.66 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.501 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 3.0 tp10 74.31 41.79 0.36 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.261 -0.9 . . . . 0.0 109.353 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.455 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 72.51 51.48 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.304 -0.872 . . . . 0.0 109.447 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 24.7 tt0 -88.65 -70.16 0.66 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.492 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 1.4 t -87.47 -21.21 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.349 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.13 HG11 ' CD ' ' B' ' 33' ' ' LYS . 77.0 t -73.54 -26.06 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.207 -0.933 . . . . 0.0 109.27 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -85.16 -47.95 9.62 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 109.438 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 14.0 mttt -62.58 -41.9 99.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.213 -0.929 . . . . 0.0 109.395 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.917 ' HB ' HD13 ' B' ' 60' ' ' LEU . 31.1 m -59.28 -49.34 83.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 O-C-N 121.196 -0.94 . . . . 0.0 109.474 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -44.5 -26.38 0.35 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.977 -1.077 . . . . 0.0 109.453 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 55' ' ' LYS . 0.8 OUTLIER -77.08 -45.79 25.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.224 -0.922 . . . . 0.0 108.994 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.443 ' O ' ' C ' ' B' ' 60' ' ' LEU . 66.5 m -84.31 -63.81 1.27 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.312 -0.867 . . . . 0.0 109.371 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.917 HD13 ' HB ' ' B' ' 56' ' ' VAL . 9.1 mp -41.73 -27.86 0.12 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.585 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' B' ' 57' ' ' MET . 3.6 m-20 -63.55 114.68 4.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.256 -0.903 . . . . 0.0 109.333 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' B' ' 67' ' ' GLU . 2.6 t-20 -42.77 -44.31 4.34 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.386 -0.821 . . . . 0.0 109.623 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.73 28.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.245 -0.909 . . . . 0.0 109.566 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.3 90.87 1.18 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' B' ' 65' ' ' ASP . 43.5 t0 -179.34 -34.44 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.11 . . . . 0.0 108.581 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.479 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.12 38.65 1.64 Allowed Glycine 0 N--CA 1.485 1.912 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' B' ' 62' ' ' ASN . 15.2 pt-20 -141.09 105.74 4.9 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.205 -1.174 . . . . 0.0 109.469 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.488 ' N ' ' HB3' ' B' ' 26' ' ' LYS . 12.2 t -78.59 153.4 31.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.256 -0.902 . . . . 0.0 109.748 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.495 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -110.13 171.16 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -61.27 -48.95 79.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.155 -0.965 . . . . 0.0 109.973 -179.804 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.582 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 9.4 mp0 -54.84 -40.19 69.35 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 108.953 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.2 mt-10 -78.83 -18.47 53.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.407 -0.808 . . . . 0.0 109.527 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.763 ' CZ ' HD23 ' B' ' 10' ' ' LEU . 3.5 t80 -67.25 -62.14 1.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.181 -0.949 . . . . 0.0 109.046 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.959 ' HB3' ' HB2' ' A' ' 78' ' ' ALA . 1.8 tpp -63.51 -48.04 79.23 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.108 -0.995 . . . . 0.0 108.978 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.684 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -51.54 -36.47 45.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.161 -0.962 . . . . 0.0 108.622 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.757 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.2 OUTLIER -57.86 -62.95 1.44 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.235 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.605 HG21 HD21 ' B' ' 10' ' ' LEU . 3.5 t -49.74 -27.9 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.921 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -58.4 -54.56 45.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.387 -0.821 . . . . 0.0 109.093 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 54.7 mtm -71.47 -68.84 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.365 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.757 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -40.6 -26.48 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 120.602 -1.311 . . . . 0.0 110.036 -179.637 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.517 ' N ' ' O ' ' B' ' 79' ' ' MET . 3.7 m -75.11 -70.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.993 -1.067 . . . . 0.0 108.7 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.7 t -78.08 -49.63 13.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.124 -0.985 . . . . 0.0 108.455 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.78 -44.22 0.72 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.752 -0.592 . . . . 0.0 109.71 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.408 ' O ' ' HB3' ' B' ' 87' ' ' PHE . 0.5 OUTLIER -89.37 -28.86 19.5 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.571 -179.928 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' B' ' 81' ' ' THR . 0.8 OUTLIER -65.54 -70.06 0.26 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' B' ' 85' ' ' HIS . 0.0 OUTLIER -43.95 -28.32 0.45 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.505 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' B' ' 84' ' ' CYS . 11.2 t80 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.202 -0.936 . . . . 0.0 109.417 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.544 ' HB2' ' CB ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.805 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.5 OUTLIER -68.28 -79.45 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.821 HD11 HG11 ' B' ' 13' ' ' VAL . 4.9 mp -68.13 -23.04 64.85 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.164 -0.96 . . . . 0.0 109.421 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.544 ' CB ' ' HB2' ' A' ' 1' ' ' SER . 0.2 OUTLIER -63.3 -60.84 2.86 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.23 -0.918 . . . . 0.0 109.229 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 1' ' ' SER . 4.1 tttt -60.73 -29.58 69.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.342 -0.848 . . . . 0.0 109.182 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -71.42 -26.72 62.87 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.34 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.474 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.9 ttm -75.62 -38.71 58.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.332 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.84 -39.49 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.313 -0.867 . . . . 0.0 109.433 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.815 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -72.85 -62.93 1.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 109.508 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.675 ' CD2' HD23 ' B' ' 3' ' ' LEU . 48.7 mt -44.12 -43.69 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.385 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.474 HD12 ' O ' ' A' ' 7' ' ' MET . 62.3 mt -56.75 -53.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.5 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -54.51 -22.78 13.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.942 ' CG1' HD11 ' A' ' 35' ' ' LEU . 4.2 t -82.58 -33.7 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.29 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.547 ' CZ ' ' N ' ' A' ' 70' ' ' PHE . 9.9 t80 -63.12 -47.46 82.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.055 -1.028 . . . . 0.0 109.523 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -80.72 -46.33 15.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 109.712 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -54.52 -62.45 1.65 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 109.669 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.599 ' CD1' HG13 ' A' ' 13' ' ' VAL . 30.2 m-85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.657 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 26.2 m -60.16 -21.43 61.65 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.158 -0.964 . . . . 0.0 109.617 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.66 30.28 10.75 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' CG ' ' HA ' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.01 -50.78 5.82 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -1.17 . . . . 0.0 109.511 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . 81.3 mt-10 -134.72 83.99 2.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.258 -0.901 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.82 -170.81 54.94 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.422 ' O ' ' HD2' ' A' ' 24' ' ' LYS . 88.7 m-20 47.75 -169.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.313 -1.11 . . . . 0.0 109.502 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' C ' ' HB3' ' A' ' 18' ' ' SER . 0.3 OUTLIER -169.31 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.491 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -108.08 16.15 23.61 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.251 -0.906 . . . . 0.0 109.44 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -151.14 170.14 20.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.209 -0.932 . . . . 0.0 109.452 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.8 HD23 ' C ' ' A' ' 31' ' ' GLU . 3.0 mp -108.46 141.22 40.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.88 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.607 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.8 OUTLIER -91.15 79.19 5.77 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 109.079 179.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.586 ' CG ' ' CG ' ' A' ' 57' ' ' MET . 0.0 OUTLIER 41.53 -83.03 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.578 -0.701 . . . . 0.0 111.17 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.607 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -49.24 -27.43 3.73 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.669 -1.269 . . . . 0.0 109.711 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.8 ' C ' HD23 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -60.31 -46.19 90.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.916 -1.115 . . . . 0.0 108.617 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.706 ' N ' HD23 ' A' ' 27' ' ' LEU . 7.0 mt -59.75 -51.76 68.39 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 1.007 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -46.36 -36.53 6.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 109.338 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -53.49 43.89 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.592 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.942 HD11 ' CG1' ' A' ' 13' ' ' VAL . 4.7 mt -50.72 -52.52 39.63 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.713 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.027 HG23 HD12 ' A' ' 40' ' ' LEU . 1.9 mp -66.51 -24.59 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.262 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -90.98 -3.72 57.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.222 -0.924 . . . . 0.0 109.615 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -114.05 -14.42 12.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.239 -0.913 . . . . 0.0 109.496 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.742 ' OE1' HD22 ' B' ' 3' ' ' LEU . 5.9 pt-20 -120.94 -14.93 8.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.483 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.027 HD12 HG23 ' A' ' 36' ' ' ILE . 23.8 mt -120.2 75.12 1.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.477 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.911 ' CD1' HG21 ' A' ' 36' ' ' ILE . 43.4 mt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 7.4 pttm 40.24 28.48 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.636 -0.665 . . . . 0.0 109.877 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.492 ' H ' HG22 ' A' ' 47' ' ' ILE . 5.8 tt0 170.56 -78.83 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -0.873 . . . . 0.0 109.3 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 14.1 pt20 -168.04 26.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.874 . . . . 0.0 109.518 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.25 -69.28 0.3 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.234 -0.916 . . . . 0.0 109.413 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.769 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.6 t -86.67 -21.13 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 109.342 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.007 HG11 ' HG3' ' A' ' 33' ' ' LYS . 41.3 t -77.02 -19.29 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.286 -0.884 . . . . 0.0 109.762 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 53.9 t0 -90.06 -36.5 14.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.181 -0.949 . . . . 0.0 109.598 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -79.74 -38.01 34.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 52' ' ' VAL . 30.8 m -60.43 -43.74 94.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.193 -0.942 . . . . 0.0 109.773 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.586 ' CG ' ' CG ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -39.78 -29.08 0.05 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.078 -1.014 . . . . 0.0 109.488 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.495 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -87.04 -42.56 12.99 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.908 HG21 ' CE ' ' A' ' 79' ' ' MET . 98.9 m -70.03 -64.92 0.8 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.79 . . . . 0.0 109.587 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.64 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 7.3 mt -38.4 -60.43 0.79 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.474 -0.766 . . . . 0.0 109.589 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.41 112.26 6.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.271 -0.893 . . . . 0.0 109.534 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -120.02 16.67 12.5 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.415 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.24 -47.87 2.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 92.17 2.18 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.89 -35.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -1.126 . . . . 0.0 108.567 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.12 22.83 6.66 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HB2' ' HE2' ' A' ' 26' ' ' LYS . 19.5 pt-20 -128.44 118.54 23.28 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -1.119 . . . . 0.0 109.437 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.82 132.51 46.17 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.25 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 1.2 p30 -104.59 169.62 8.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.301 -0.874 . . . . 0.0 108.97 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.547 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.19 -47.99 54.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.059 -1.026 . . . . 0.0 110.105 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 75' ' ' ALA . 14.1 pt20 -52.48 -37.5 57.35 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.672 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.524 ' OE2' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -82.38 -20.5 37.04 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.065 -1.022 . . . . 0.0 109.775 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 1.6 t80 -66.66 -64.27 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.133 -0.979 . . . . 0.0 109.061 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.867 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.9 -32.82 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.384 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.663 ' HA ' ' HB2' ' B' ' 75' ' ' ALA . . . -65.33 -31.71 72.98 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.263 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.736 ' CZ ' HG21 ' A' ' 56' ' ' VAL . 1.1 t80 -70.44 -59.22 2.98 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.293 -0.879 . . . . 0.0 108.976 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.447 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.4 t -56.57 -25.39 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.989 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.67 -49.2 71.9 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.383 -0.823 . . . . 0.0 109.369 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.908 ' CE ' HG21 ' A' ' 59' ' ' THR . 2.3 mtm -71.94 -70.76 0.31 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.333 -0.855 . . . . 0.0 109.682 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.8 HG11 HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -41.91 -25.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 O-C-N 120.623 -1.298 . . . . 0.0 110.242 -179.187 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.606 HG21 ' HE1' ' B' ' 74' ' ' MET . 3.8 m -74.91 -68.03 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.875 -1.141 . . . . 0.0 108.589 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.8 m -81.68 -51.48 8.15 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.07 -40.64 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.206 0.527 . . . . 0.0 109.913 179.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 12.0 t -79.02 -40.89 30.22 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.605 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.2 OUTLIER -64.98 -11.89 43.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.139 -0.975 . . . . 0.0 109.477 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.451 ' OE2' HG23 ' A' ' 82' ' ' THR . 0.5 OUTLIER -90.31 -36.0 14.93 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.42 ' C ' ' O ' ' A' ' 86' ' ' GLU . 2.9 m-85 . . . . . 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 0.0 109.535 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.815 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 6.4 mm-40 -71.22 -63.47 1.1 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.248 -0.907 . . . . 0.0 109.386 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.76 HD11 ' CD2' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.18 -25.32 63.38 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.43 -65.6 0.67 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.317 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.426 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.1 OUTLIER -62.97 -37.06 85.58 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.273 -0.892 . . . . 0.0 109.25 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -68.71 -17.23 64.03 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.411 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.25 -39.86 20.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.503 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.456 ' O ' HG22 ' B' ' 11' ' ' ILE . 2.4 p -68.97 -31.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.17 -0.956 . . . . 0.0 109.449 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -83.3 -50.42 8.4 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.562 HD12 ' O ' ' B' ' 6' ' ' ALA . 5.4 mt -57.75 -34.71 69.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.794 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -73.26 -47.61 46.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.15 -0.969 . . . . 0.0 109.402 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.576 ' N ' HG23 ' B' ' 11' ' ' ILE . 65.8 t0 -57.34 -19.96 25.83 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.124 -0.985 . . . . 0.0 108.894 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.869 HG22 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -88.14 -41.94 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.37 -0.831 . . . . 0.0 109.632 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.473 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 34.2 t80 -53.93 -42.89 69.3 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.887 -1.133 . . . . 0.0 109.041 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.417 ' O ' ' C ' ' B' ' 16' ' ' GLN . 8.3 t-160 -77.58 -38.65 47.88 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.346 -0.846 . . . . 0.0 109.281 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' B' ' 15' ' ' HIS . 0.9 OUTLIER -44.03 -48.61 8.83 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 108.958 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.869 ' CE2' HG22 ' B' ' 13' ' ' VAL . 12.7 m-85 -92.47 -70.27 0.7 Allowed 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.403 -0.811 . . . . 0.0 109.107 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 4.1 p 38.87 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.594 -0.691 . . . . 0.0 109.99 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 88.12 44.19 5.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.428 ' C ' ' O ' ' B' ' 19' ' ' GLY . 0.1 OUTLIER -42.49 -27.42 0.16 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -1.042 . . . . 0.0 109.625 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.434 ' O ' ' HE2' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -100.05 69.91 1.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.03 -115.51 2.34 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' B' ' 19' ' ' GLY . 70.6 m-20 -61.85 148.61 42.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -1.17 . . . . 0.0 109.551 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.9 tttt -119.29 34.6 5.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.258 -0.901 . . . . 0.0 109.512 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.536 ' HB2' ' CE ' ' B' ' 26' ' ' LYS . 33.9 m170 -136.98 8.84 3.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.536 ' CE ' ' HB2' ' B' ' 25' ' ' HIS . 0.3 OUTLIER -169.95 156.24 6.03 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.713 ' CD1' HD12 ' B' ' 35' ' ' LEU . 9.8 mt -85.08 147.5 26.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -125.63 85.75 2.44 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.839 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.633 ' HA ' HD12 ' B' ' 32' ' ' LEU . 12.6 tppt? 60.97 -86.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.361 -0.837 . . . . 0.0 110.211 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.508 ' N ' ' HG3' ' B' ' 29' ' ' LYS . 7.2 m -44.04 -52.49 7.07 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.172 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' B' ' 27' ' ' LEU . 0.3 OUTLIER -55.91 -38.42 70.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.12 -0.987 . . . . 0.0 109.469 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 29' ' ' LYS . 36.7 mt -61.25 -70.17 0.2 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.579 -0.701 . . . . 0.0 109.291 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.1 OUTLIER -44.85 -24.61 0.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.687 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.446 ' OE1' ' O ' ' B' ' 30' ' ' SER . 0.1 OUTLIER -71.52 -69.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.134 -0.979 . . . . 0.0 109.537 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.811 HD21 ' CG1' ' B' ' 13' ' ' VAL . 2.4 mt -43.99 -47.91 8.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.305 -0.872 . . . . 0.0 109.732 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.767 ' CG2' HG11 ' B' ' 80' ' ' VAL . 11.6 mm -60.93 -43.07 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.656 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.459 ' HA ' ' HB3' ' B' ' 41' ' ' SER . 13.5 m-80 -90.18 8.38 33.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' B' ' 34' ' ' GLU . 2.1 t30 -94.0 -46.25 7.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.199 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.541 ' OE1' HD13 ' A' ' 3' ' ' LEU . 3.8 mp0 -124.64 -9.9 7.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.896 . . . . 0.0 109.601 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.732 HD11 HG13 ' B' ' 77' ' ' VAL . 5.2 mp -112.93 37.38 3.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.203 -0.935 . . . . 0.0 109.496 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' B' ' 37' ' ' ASN . 2.9 p . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.185 -0.947 . . . . 0.0 109.489 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.962 HD11 ' CG1' ' B' ' 80' ' ' VAL . 43.7 mt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.512 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.0 mtmt 43.54 27.02 0.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.251 -0.906 . . . . 0.0 109.516 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 170.85 -75.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.409 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' HB ' ' B' ' 53' ' ' VAL . 0.5 OUTLIER -169.62 27.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.218 -0.926 . . . . 0.0 109.553 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.79 -70.24 0.27 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.217 -0.927 . . . . 0.0 109.303 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.979 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.0 t -87.76 -14.72 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.195 -0.941 . . . . 0.0 109.258 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.759 HG23 HD13 ' B' ' 47' ' ' ILE . 43.1 t -77.73 -19.16 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.116 -0.99 . . . . 0.0 109.249 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -90.09 -37.18 14.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.227 -0.921 . . . . 0.0 109.284 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -47.5 20.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.309 -0.869 . . . . 0.0 109.352 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.925 HG11 HG22 ' B' ' 80' ' ' VAL . 31.1 m -55.3 -46.2 78.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.229 -0.919 . . . . 0.0 109.63 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.16 -47.47 6.23 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.204 -0.935 . . . . 0.0 109.887 -179.675 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.17 -56.42 21.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 109.824 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.998 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.7 t -67.64 -9.43 43.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.201 -0.937 . . . . 0.0 109.803 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.83 HD21 ' CD2' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -97.95 -11.47 23.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 0.0 109.52 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.438 ' OD2' ' SD ' ' B' ' 57' ' ' MET . 48.9 m-20 -83.47 114.78 21.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.355 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -101.24 -17.31 16.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.935 . . . . 0.0 109.67 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -141.06 8.97 2.1 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.157 -0.965 . . . . 0.0 109.741 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 71.79 94.48 0.08 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 1.0 OUTLIER 169.22 -28.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.333 -1.098 . . . . 0.0 108.45 -179.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.48 -5.69 29.84 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.512 ' HB3' ' CD ' ' B' ' 26' ' ' LYS . 1.8 mm-40 -69.91 110.34 4.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -1.147 . . . . 0.0 109.219 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 14.3 t -87.89 156.49 19.34 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.179 -0.951 . . . . 0.0 109.675 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.452 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.6 OUTLIER -116.33 170.9 8.19 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.584 ' CZ ' HG12 ' B' ' 11' ' ' ILE . 1.2 t80 -57.73 -51.58 68.97 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.197 -0.94 . . . . 0.0 110.167 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.75 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.0 pt20 -53.81 -44.05 69.87 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.466 -0.771 . . . . 0.0 109.3 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' B' ' 76' ' ' PHE . 3.3 mt-10 -74.05 -19.37 60.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.328 -0.857 . . . . 0.0 109.617 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.537 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 12.6 t80 -65.7 -63.1 1.17 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.244 -0.91 . . . . 0.0 109.178 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.989 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 0.5 OUTLIER -58.65 -46.07 87.93 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.196 -0.94 . . . . 0.0 108.743 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' HA ' ' A' ' 75' ' ' ALA . . . -58.44 -26.53 63.43 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.221 -0.924 . . . . 0.0 108.525 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.83 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.0 OUTLIER -64.17 -69.26 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.732 HG13 HD11 ' B' ' 40' ' ' LEU . 39.3 t -51.68 -23.65 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.437 -0.789 . . . . 0.0 109.122 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.867 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -63.95 -45.58 88.51 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.289 -0.882 . . . . 0.0 109.304 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.998 ' SD ' HG21 ' B' ' 59' ' ' THR . 42.7 mtm -78.03 -64.35 1.18 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.89 . . . . 0.0 109.677 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.979 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.89 -23.04 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 O-C-N 120.481 -1.387 . . . . 0.0 109.526 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.603 ' OG1' HD21 ' B' ' 40' ' ' LEU . 4.8 m -78.85 -67.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.04 -1.037 . . . . 0.0 109.113 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.2 t -77.1 -49.3 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.0 109.037 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.92 -39.86 0.25 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.747 -0.595 . . . . 0.0 109.966 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 29.6 t -67.55 -49.38 63.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.242 -0.911 . . . . 0.0 109.554 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -9.93 51.73 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.564 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 87' ' ' PHE . 1.6 tm-20 -89.9 -23.65 21.56 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.229 -0.919 . . . . 0.0 109.525 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' B' ' 86' ' ' GLU . 3.4 t80 . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 1.2 m . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.615 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -62.1 -39.2 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.257 -0.902 . . . . 0.0 109.612 -179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.782 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.2 mm? -80.56 -28.52 37.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.24 -0.912 . . . . 0.0 109.551 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 8.8 tp10 -64.9 -58.64 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mmtt -65.79 -37.75 87.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.253 -0.904 . . . . 0.0 109.581 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -67.59 -18.45 64.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.617 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.527 ' HG2' HD12 ' A' ' 11' ' ' ILE . 14.4 ttp -82.6 -49.68 9.59 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.928 . . . . 0.0 109.561 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.95 -27.71 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' B' ' 2' ' ' GLU . . . -78.29 -65.63 0.95 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.576 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.66 HD13 ' HG3' ' A' ' 74' ' ' MET . 19.9 mt -49.76 -46.13 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.585 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.527 HD12 ' HG2' ' A' ' 7' ' ' MET . 50.8 mt -58.88 -44.86 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.523 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 26.4 t0 -62.59 -21.42 65.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.935 HG11 HD21 ' B' ' 3' ' ' LEU . 2.8 t -85.25 -26.0 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.2 -0.938 . . . . 0.0 109.425 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 2.9 t80 -72.43 -52.08 17.49 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.974 -1.078 . . . . 0.0 109.285 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.545 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 0.3 OUTLIER -74.48 -30.31 61.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.885 . . . . 0.0 109.635 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 25.3 tt0 -72.4 -63.32 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 0.0 109.603 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.527 ' HA ' ' CD ' ' A' ' 20' ' ' ARG . 11.2 m-85 -56.44 -28.86 60.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.251 -0.905 . . . . 0.0 109.411 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.545 ' HG ' ' HA ' ' A' ' 15' ' ' HIS . 60.8 p -77.59 -31.0 52.73 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.498 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.51 -22.56 63.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 17.3 mtp85 -69.04 -27.6 65.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -1.144 . . . . 0.0 109.453 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.521 ' CG ' ' N ' ' A' ' 22' ' ' GLY . 46.8 tt0 -97.91 165.74 11.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.252 -0.905 . . . . 0.0 109.393 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.521 ' N ' ' CG ' ' A' ' 21' ' ' GLU . . . -43.93 -63.01 2.42 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.01 -177.68 0.28 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.284 -1.127 . . . . 0.0 109.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 15' ' ' HIS . 28.8 mtmt -143.69 45.56 1.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.253 -0.905 . . . . 0.0 109.469 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.437 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t60 -164.91 25.7 0.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 109.455 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.745 ' C ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -170.03 170.21 7.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.264 -0.898 . . . . 0.0 109.486 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 26' ' ' LYS . 9.7 mp -120.49 164.69 16.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.487 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -122.59 69.65 0.98 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.235 -0.916 . . . . 0.0 109.504 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.668 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER 63.05 -83.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.618 -0.676 . . . . 0.0 110.686 179.441 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -46.68 -35.4 5.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.146 -0.971 . . . . 0.0 110.86 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.597 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.7 mp0 -62.64 -42.3 99.52 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 108.851 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.703 HD22 ' CD2' ' A' ' 60' ' ' LEU . 5.1 mt -57.6 -56.62 19.6 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.633 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.5 -45.35 4.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.426 -0.796 . . . . 0.0 109.431 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.422 ' HG2' ' NH2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -63.86 -42.39 97.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.346 -0.846 . . . . 0.0 109.616 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.596 HD21 HG13 ' A' ' 13' ' ' VAL . 18.6 mt -48.18 -60.25 2.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.26 -0.9 . . . . 0.0 109.799 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.822 HD13 ' CE2' ' A' ' 76' ' ' PHE . 1.8 mp -75.55 -16.9 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.308 -0.87 . . . . 0.0 109.729 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.509 HD21 HD11 ' A' ' 47' ' ' ILE . 1.8 m-80 -93.62 1.09 56.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.188 -0.945 . . . . 0.0 109.709 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 34' ' ' GLU . 14.7 t30 -117.1 -25.39 7.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.138 -0.977 . . . . 0.0 109.295 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.597 ' HB2' HD12 ' B' ' 3' ' ' LEU . 68.8 mm-40 -126.58 -10.14 6.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.901 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.793 HD13 HG13 ' A' ' 36' ' ' ILE . 0.3 OUTLIER -120.08 56.61 0.96 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.042 -1.036 . . . . 0.0 109.489 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.7 p . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.301 -0.874 . . . . 0.0 109.385 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.73 HG13 HG21 ' A' ' 53' ' ' VAL . 8.2 mm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.6 mttt -86.27 61.82 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.252 -0.905 . . . . 0.0 109.251 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.5 OUTLIER 83.29 -42.49 0.1 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 109.647 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.49 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 2.1 mt-30 167.43 57.95 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.093 -1.004 . . . . 0.0 109.341 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 2.0 tt0 -89.29 -70.34 0.66 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.157 -0.964 . . . . 0.0 109.587 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.788 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.1 t -90.54 -20.74 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.113 -0.992 . . . . 0.0 109.238 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.73 HG21 HG13 ' A' ' 47' ' ' ILE . 24.9 t -77.22 -29.11 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.156 -0.965 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 0.5 OUTLIER -90.12 -32.41 16.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.38 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 1.1 tmtp? -75.88 -37.76 58.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.407 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 1.013 ' HB ' HD13 ' A' ' 60' ' ' LEU . 8.8 m -56.35 -53.2 42.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.211 -0.93 . . . . 0.0 109.748 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.592 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -40.16 -28.91 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.155 -0.966 . . . . 0.0 109.53 -179.713 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -75.03 -50.54 16.18 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.468 HG21 ' SD ' ' A' ' 79' ' ' MET . 14.3 m -79.19 -64.8 1.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 108.794 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.108 HD21 ' CG ' ' A' ' 76' ' ' PHE . 4.2 mp -38.09 -47.82 1.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.708 -0.62 . . . . 0.0 109.756 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 57' ' ' MET . 0.5 OUTLIER -88.3 86.9 7.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.54 -7.64 7.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.513 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -78.27 -41.7 33.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.488 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.46 2.12 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -177.28 -35.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.244 -1.151 . . . . 0.0 108.593 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.35 -13.38 36.51 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.485 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 8.5 mt-10 -108.67 147.38 31.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -1.13 . . . . 0.0 109.515 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.52 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 1.9 t -69.79 147.74 50.04 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.307 -0.87 . . . . 0.0 109.601 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -116.63 170.98 8.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.513 -0.742 . . . . 0.0 109.359 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -61.45 -52.05 66.16 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.346 -0.847 . . . . 0.0 110.453 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -51.94 -39.32 59.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.327 -0.858 . . . . 0.0 109.548 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.52 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 1.6 pt-20 -79.6 -22.58 43.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.157 -0.965 . . . . 0.0 109.637 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.411 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 10.8 t80 -62.28 -59.53 4.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 109.003 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.845 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 2.4 ttm -65.22 -44.8 87.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.314 -0.867 . . . . 0.0 109.1 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.24 -22.17 62.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.009 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 1.108 ' CG ' HD21 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.48 -63.59 1.09 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.815 . . . . 0.0 108.838 179.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.705 HG13 HD11 ' A' ' 40' ' ' LEU . 42.0 t -56.52 -23.1 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -63.48 -49.97 71.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.499 -0.751 . . . . 0.0 109.065 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.696 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 39.1 mtp -72.77 -70.11 0.37 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.388 -0.82 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -41.25 -25.84 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 120.575 -1.328 . . . . 0.0 110.02 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 1.018 HG21 HD11 ' B' ' 11' ' ' ILE . 4.6 m -77.67 -69.96 0.51 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.936 -1.102 . . . . 0.0 108.629 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -77.8 -49.91 13.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.093 -1.004 . . . . 0.0 108.325 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.25 -48.21 1.77 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.371 0.605 . . . . 0.0 109.453 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 13.4 t -61.03 -46.3 91.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.317 -0.864 . . . . 0.0 109.403 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -68.43 -11.19 59.34 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.456 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' A' ' 87' ' ' PHE . 4.8 tp10 -86.99 -37.26 17.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.4 ' C ' ' O ' ' A' ' 86' ' ' GLU . 49.2 t80 . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.553 ' HB3' ' N ' ' B' ' 5' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.487 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 2.5 mp0 39.23 -93.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.577 -0.702 . . . . 0.0 110.249 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.935 HD21 HG11 ' A' ' 13' ' ' VAL . 20.5 mt -75.83 -50.41 15.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.932 . . . . 0.0 109.43 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' B' ' 1' ' ' SER . 0.9 OUTLIER -49.87 -34.54 20.43 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.176 -0.952 . . . . 0.0 109.023 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.553 ' N ' ' HB3' ' B' ' 1' ' ' SER . 0.5 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.256 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.493 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -66.15 -10.0 36.91 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 109.339 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.734 ' O ' HD12 ' B' ' 11' ' ' ILE . 4.0 mtp -80.5 -57.71 3.46 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.267 -0.895 . . . . 0.0 109.392 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 16.5 t -64.23 -32.71 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.3 -0.875 . . . . 0.0 109.351 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.615 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -70.19 -68.9 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.333 -0.854 . . . . 0.0 109.561 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 1.048 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -51.3 -60.39 3.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.255 -0.903 . . . . 0.0 109.493 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 81' ' ' THR . 28.2 mt -42.86 -41.06 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -59.12 -47.92 83.49 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.364 -0.835 . . . . 0.0 109.659 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.946 HG22 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -61.23 -34.05 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.137 -0.977 . . . . 0.0 109.673 -179.616 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.59 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 9.1 t80 -60.11 -70.32 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.045 -1.034 . . . . 0.0 109.159 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -64.79 -9.82 23.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.723 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.501 ' HB3' ' HA ' ' B' ' 13' ' ' VAL . 56.7 tp60 -75.49 -69.93 0.45 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.834 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 1.169 ' CE2' HD23 ' B' ' 35' ' ' LEU . 0.0 OUTLIER -100.26 21.37 13.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.145 -0.972 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.602 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.5 t -80.86 -19.9 43.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 109.328 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.508 ' CA ' ' HA ' ' B' ' 24' ' ' LYS . . . -103.1 8.71 53.94 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.471 ' HG2' ' CA ' ' B' ' 17' ' ' TYR . 22.1 mmt180 -52.89 -54.28 36.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -1.177 . . . . 0.0 109.449 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' CE ' ' B' ' 28' ' ' LYS . 1.0 OUTLIER -127.91 103.55 7.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.57 -147.48 16.42 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.47 ' O ' ' HA2' ' B' ' 19' ' ' GLY . 0.2 OUTLIER -71.41 167.28 19.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.249 -1.147 . . . . 0.0 109.474 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.508 ' HA ' ' CA ' ' B' ' 19' ' ' GLY . 3.5 mttp -104.93 40.85 1.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.924 . . . . 0.0 109.496 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -134.17 11.39 3.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.226 -0.921 . . . . 0.0 109.437 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.5 OUTLIER -161.71 169.99 20.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.458 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.804 HD13 ' OH ' ' B' ' 17' ' ' TYR . 59.1 mt -120.61 141.01 50.73 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.707 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.52 ' CE ' ' O ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -87.25 165.72 15.46 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.489 ' N ' ' HD3' ' B' ' 29' ' ' LYS . 6.8 mmtp -42.72 -31.86 0.52 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.267 -0.896 . . . . 0.0 109.011 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 30.6 p -73.5 -58.0 3.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.443 -0.786 . . . . 0.0 110.189 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.798 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.6 mp0 -45.61 -44.32 12.97 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.047 -1.033 . . . . 0.0 109.117 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' B' ' 27' ' ' LEU . 24.7 mt -54.09 -62.74 1.46 Allowed 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.636 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.2 OUTLIER -47.26 -23.17 0.5 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.893 . . . . 0.0 110.072 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 30' ' ' SER . 23.2 mm-40 -75.82 -70.28 0.44 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.976 -1.078 . . . . 0.0 109.99 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 1.169 HD23 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -42.98 -33.03 0.72 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.414 -0.804 . . . . 0.0 109.634 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.979 HD13 HG11 ' B' ' 80' ' ' VAL . 14.5 mt -72.5 -45.24 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.152 -0.967 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.438 ' O ' ' HB3' ' B' ' 41' ' ' SER . 1.9 m-80 -72.6 -9.36 58.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.539 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.56 -51.21 7.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.913 . . . . 0.0 109.369 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 3' ' ' LEU . 1.3 tt0 -102.67 -43.43 5.6 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.0 109.348 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' B' ' 36' ' ' ILE . 1.0 OUTLIER -86.63 58.75 5.24 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 109.484 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' B' ' 37' ' ' ASN . 6.8 p . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.439 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.861 HG13 HG21 ' B' ' 53' ' ' VAL . 1.8 mm . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.522 ' NZ ' ' HG3' ' B' ' 51' ' ' GLU . 9.8 pttt -43.26 -45.51 5.83 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.238 -0.914 . . . . 0.0 109.544 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.476 ' CG ' ' C ' ' B' ' 48' ' ' LYS . 7.1 mt-10 -154.83 -39.65 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.875 . . . . 0.0 109.301 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 167.72 58.97 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.319 -0.863 . . . . 0.0 109.383 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.522 ' HG3' ' NZ ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -86.45 -70.29 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.34 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.92 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -87.78 -27.11 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.929 . . . . 0.0 109.047 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.861 HG21 HG13 ' B' ' 47' ' ' ILE . 54.5 t -68.18 -20.42 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.306 -0.871 . . . . 0.0 109.042 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 4.8 t0 -90.16 -51.37 5.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.354 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -58.06 -33.88 69.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 52' ' ' VAL . 25.3 m -58.56 -50.82 77.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.168 -0.957 . . . . 0.0 109.519 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.603 ' HE1' HD11 ' B' ' 32' ' ' LEU . 0.8 OUTLIER -44.91 -26.25 0.39 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.923 -1.11 . . . . 0.0 109.373 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' B' ' 56' ' ' VAL . 9.8 mt-10 -74.9 -47.08 31.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.264 -0.897 . . . . 0.0 108.978 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.464 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 45.0 m -85.01 -63.47 1.32 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.274 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.949 HD21 ' CD1' ' B' ' 76' ' ' PHE . 10.7 mp -38.33 -32.99 0.08 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.608 -0.682 . . . . 0.0 109.902 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.456 ' OD2' ' O ' ' B' ' 57' ' ' MET . 76.0 m-20 -90.15 112.35 23.81 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.182 -0.949 . . . . 0.0 109.553 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.495 ' ND2' ' OE2' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -124.95 -29.3 3.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.225 -0.922 . . . . 0.0 109.641 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.401 ' OD1' ' HG3' ' B' ' 67' ' ' GLU . 1.4 p30 -82.17 -12.18 58.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.225 -0.922 . . . . 0.0 109.612 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 70.08 85.92 0.14 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 12.9 t0 178.14 -32.32 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.321 -1.105 . . . . 0.0 108.678 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.489 ' HA2' ' HE2' ' B' ' 29' ' ' LYS . . . 110.36 38.22 1.67 Allowed Glycine 0 N--CA 1.485 1.938 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -135.42 119.52 17.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.337 -1.096 . . . . 0.0 109.335 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.473 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 16.4 t -69.73 156.96 38.2 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 0.0 109.854 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.504 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -120.64 171.77 8.34 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.709 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -62.6 -50.94 69.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.353 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.414 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.8 pt20 -55.45 -40.18 71.25 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.139 -0.975 . . . . 0.0 108.944 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.8 OUTLIER -78.95 -17.9 54.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.314 -0.866 . . . . 0.0 109.184 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 1.048 ' CE2' HD23 ' B' ' 10' ' ' LEU . 5.3 t80 -65.41 -57.34 8.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.877 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -64.01 -42.13 97.24 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.011 -1.056 . . . . 0.0 108.408 179.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -67.64 -16.34 64.11 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.335 -0.853 . . . . 0.0 108.798 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.949 ' CD1' HD21 ' B' ' 60' ' ' LEU . 2.1 t80 -71.8 -62.63 1.35 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.466 ' HA ' HG23 ' B' ' 80' ' ' VAL . 75.2 t -62.0 -26.77 40.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.845 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -60.77 -44.72 96.4 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.39 -0.819 . . . . 0.0 109.099 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.677 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 12.8 mtp -73.67 -69.88 0.41 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.276 -0.89 . . . . 0.0 109.155 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.979 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -41.86 -26.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.7 -1.25 . . . . 0.0 109.615 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.502 ' N ' ' O ' ' B' ' 79' ' ' MET . 12.5 m -75.64 -70.09 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.043 -1.036 . . . . 0.0 108.868 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.569 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.9 t -78.07 -49.45 13.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.121 -0.987 . . . . 0.0 108.574 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.31 -41.53 0.63 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.257 0.551 . . . . 0.0 109.856 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.94 -36.45 27.98 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 109.649 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.8 t-160 -67.96 -9.95 49.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.165 -0.959 . . . . 0.0 109.658 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.514 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 1.4 pp20? -80.64 -13.43 59.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 109.61 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.168 -0.957 . . . . 0.0 109.545 -179.937 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.461 ' CB ' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.759 ' OE1' ' HB1' ' B' ' 9' ' ' ALA . 0.2 OUTLIER -63.9 -71.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.784 HD21 ' HZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -68.72 -24.54 64.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.538 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.461 ' HB2' ' CB ' ' A' ' 1' ' ' SER . 0.2 OUTLIER -59.67 -52.8 63.94 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.457 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -65.86 -48.89 70.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -60.81 -17.47 49.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.9 ttp -77.68 -61.43 1.99 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.197 -0.939 . . . . 0.0 109.54 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -49.69 -34.2 8.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.258 -0.902 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -66.4 0.56 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.506 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.47 ' HG ' HD22 ' B' ' 3' ' ' LEU . 0.3 OUTLIER -45.42 -25.73 0.46 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.905 HD13 ' HZ ' ' A' ' 70' ' ' PHE . 17.7 mm -68.93 -53.85 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.267 -0.896 . . . . 0.0 109.498 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.53 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 7.4 t0 -61.48 -18.73 60.35 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.31 -0.869 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.703 HG11 HD11 ' B' ' 3' ' ' LEU . 2.1 t -87.67 -28.84 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.254 -0.904 . . . . 0.0 109.374 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 5.1 t80 -70.05 -46.53 64.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.018 -1.051 . . . . 0.0 109.339 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.456 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 15.1 t-80 -80.5 -34.53 35.67 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.329 -0.857 . . . . 0.0 109.711 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.1 tt0 -65.17 -57.74 7.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.2 -0.938 . . . . 0.0 109.606 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.628 ' HE1' HG22 ' A' ' 13' ' ' VAL . 50.6 m-85 -65.45 -33.51 76.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.899 . . . . 0.0 109.569 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.535 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 59.9 p -82.23 0.96 38.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.216 -0.927 . . . . 0.0 109.698 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.94 -22.86 75.95 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 5.2 mtt-85 -77.03 -15.47 59.6 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.261 -1.141 . . . . 0.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -93.52 168.2 11.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 109.439 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -72.73 -38.1 57.07 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 1.8 m-20 -62.47 -34.92 77.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.126 . . . . 0.0 109.439 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 16.6 mtpt 74.97 0.82 3.64 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.579 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.2 m170 -138.11 7.42 2.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.0 109.573 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.535 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.0 OUTLIER -137.83 142.98 40.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.205 -0.934 . . . . 0.0 109.437 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.843 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.7 mp -86.85 161.15 18.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.171 -0.956 . . . . 0.0 109.51 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.52 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -126.59 73.73 1.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.291 -0.881 . . . . 0.0 109.279 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.636 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.6 tttm 63.71 -84.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.607 -0.683 . . . . 0.0 110.267 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 m -44.69 -48.24 10.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.168 -0.957 . . . . 0.0 110.535 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.843 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -56.62 -39.86 74.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.926 -1.109 . . . . 0.0 109.358 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.925 HD22 HD23 ' A' ' 60' ' ' LEU . 25.0 mt -60.88 -65.81 0.63 Allowed 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.542 -0.724 . . . . 0.0 109.208 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.575 ' HG3' HG11 ' A' ' 53' ' ' VAL . 3.7 ttpt -42.74 -27.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.346 -0.846 . . . . 0.0 109.527 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -67.22 -63.98 0.95 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.211 -0.931 . . . . 0.0 109.353 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.594 ' CD2' HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -44.32 -32.91 1.45 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.879 . . . . 0.0 109.528 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.681 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -70.13 -49.89 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.937 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HD11 ' A' ' 47' ' ' ILE . 2.7 m-20 -86.96 11.91 12.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 109.659 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.417 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -109.46 -40.96 4.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.163 -0.961 . . . . 0.0 109.517 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.628 ' HG2' HD12 ' B' ' 3' ' ' LEU . 0.0 OUTLIER -121.61 -22.53 5.84 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.631 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.924 HD13 ' HB ' ' A' ' 80' ' ' VAL . 16.9 mt -97.18 33.4 1.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.144 -0.973 . . . . 0.0 109.438 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.457 179.904 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 1.008 HD13 HG21 ' A' ' 53' ' ' VAL . 33.0 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.2 mtmt 75.16 26.28 1.24 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.277 -0.89 . . . . 0.0 109.322 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 tt0 83.33 -43.38 0.1 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.693 -0.629 . . . . 0.0 109.802 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.418 ' CD ' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -178.15 54.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.075 -1.015 . . . . 0.0 109.499 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 48' ' ' LYS . 50.2 tp10 -90.03 -70.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.487 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.787 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.7 t -90.97 -16.12 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.173 -0.954 . . . . 0.0 109.316 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.008 HG21 HD13 ' A' ' 47' ' ' ILE . 41.2 t -80.76 -24.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.0 108.96 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.82 -33.07 21.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 109.119 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -41.97 26.83 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.35 -0.844 . . . . 0.0 109.293 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.958 ' HB ' HD13 ' A' ' 60' ' ' LEU . 28.6 m -58.81 -49.24 83.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 O-C-N 121.251 -0.906 . . . . 0.0 109.493 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.581 ' N ' HG23 ' A' ' 56' ' ' VAL . 4.3 tpt -42.97 -27.01 0.16 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.505 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 56' ' ' VAL . 2.0 tm-20 -79.04 -45.68 19.67 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.266 -0.897 . . . . 0.0 109.114 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 60' ' ' LEU . 22.3 m -79.03 -63.48 1.41 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 109.505 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.958 HD13 ' HB ' ' A' ' 56' ' ' VAL . 7.6 mp -37.92 -43.85 0.73 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.613 -0.679 . . . . 0.0 109.955 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.491 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 8.0 m-20 -90.11 69.99 7.29 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.159 -0.963 . . . . 0.0 109.453 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -95.69 -9.4 32.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' O ' ' A' ' 67' ' ' GLU . 2.7 p-10 -78.86 -13.45 59.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.182 -0.948 . . . . 0.0 109.503 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 65.26 83.86 0.09 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 13.5 t0 177.63 -32.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.206 -1.173 . . . . 0.0 108.658 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.24 36.57 1.94 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' OD1' ' A' ' 63' ' ' ASP . 39.5 mt-10 -148.94 124.18 10.19 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.299 -1.118 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.527 ' O ' ' CD ' ' A' ' 26' ' ' LYS . 14.0 t -69.9 155.23 40.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.199 -0.938 . . . . 0.0 109.659 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.491 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -115.47 171.27 7.82 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 179.679 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.905 ' HZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -60.77 -49.73 76.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 110.149 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' B' ' 79' ' ' MET . 50.4 mt-30 -54.72 -43.42 72.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 108.997 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.491 ' HG3' ' HB2' ' A' ' 69' ' ' ASP . 1.4 mt-10 -76.78 -16.95 59.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.392 -0.818 . . . . 0.0 109.649 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.615 ' CE2' HG12 ' A' ' 13' ' ' VAL . 13.7 t80 -71.08 -52.92 16.67 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.049 -1.032 . . . . 0.0 109.161 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.857 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.6 OUTLIER -65.14 -42.23 94.03 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.162 -0.961 . . . . 0.0 108.785 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -66.7 -25.17 66.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 108.734 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.833 ' CG ' HD21 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.21 -63.0 1.26 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.74 HG12 ' HE1' ' B' ' 7' ' ' MET . 96.9 t -62.59 -25.4 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.313 -0.867 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.85 -29.08 67.33 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.455 -0.778 . . . . 0.0 109.065 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.702 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 19.5 mtp -84.59 -70.88 0.55 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.31 -0.869 . . . . 0.0 109.188 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.924 ' HB ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -44.9 -25.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 O-C-N 120.416 -1.428 . . . . 0.0 109.458 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 1.001 HG21 ' SD ' ' B' ' 7' ' ' MET . 41.7 m -81.75 -63.71 1.33 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 108.499 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.657 HG21 ' CB ' ' B' ' 70' ' ' PHE . 2.0 m -79.91 -54.6 5.66 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.702 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.51 -43.7 0.41 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.321 0.581 . . . . 0.0 109.753 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -71.14 -45.16 64.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.405 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 82' ' ' THR . 1.9 m-70 -62.43 -13.64 32.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.234 -0.916 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.88 -48.09 17.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.411 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.23 -0.919 . . . . 0.0 109.416 179.96 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.427 ' N ' ' HB3' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' B' ' 2' ' ' GLU . 1.1 tp10 -64.76 -76.46 0.07 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.249 -0.907 . . . . 0.0 109.444 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.703 HD11 HG11 ' A' ' 13' ' ' VAL . 12.1 mt -69.73 -21.4 63.46 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -0.936 . . . . 0.0 109.438 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.427 ' HB3' ' N ' ' B' ' 1' ' ' SER . 2.9 tt0 -63.92 -51.7 63.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 109.396 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -43.02 71.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.894 . . . . 0.0 109.4 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -71.7 -12.3 61.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 1.001 ' SD ' HG21 ' A' ' 81' ' ' THR . 16.7 tpp -83.71 -45.17 13.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 53.2 t -68.63 -34.15 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.759 ' HB1' ' OE1' ' A' ' 2' ' ' GLU . . . -72.07 -58.48 3.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.736 HD12 ' HB1' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -51.95 -55.24 21.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.262 -0.899 . . . . 0.0 109.476 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.699 HD11 ' CG2' ' A' ' 81' ' ' THR . 21.1 mt -47.85 -46.48 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.875 . . . . 0.0 109.5 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' B' ' 16' ' ' GLN . 5.0 t0 -56.63 -42.78 79.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.886 . . . . 0.0 109.549 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 3' ' ' LEU . 2.2 t -64.27 -25.51 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.243 -0.911 . . . . 0.0 109.572 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 31.1 t80 -72.05 -40.26 68.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.938 -1.101 . . . . 0.0 109.596 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.583 ' CE1' ' HG2' ' B' ' 24' ' ' LYS . 18.1 t60 -74.03 -38.2 64.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.915 . . . . 0.0 110.271 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -74.67 -59.62 2.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.68 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.593 ' CD1' HG13 ' B' ' 13' ' ' VAL . 15.6 m-85 -55.01 -31.89 61.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.323 -0.86 . . . . 0.0 109.496 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.563 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.5 p -86.6 -22.02 26.47 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.201 -0.937 . . . . 0.0 109.51 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -83.56 -13.59 75.55 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 37.6 mtp85 -64.17 -61.88 1.97 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -1.19 . . . . 0.0 109.46 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -133.77 124.98 27.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.66 -108.31 0.82 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -150.8 27.6 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -1.113 . . . . 0.0 109.479 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.583 ' HG2' ' CE1' ' B' ' 15' ' ' HIS . 0.0 OUTLIER 53.82 61.1 3.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 109.464 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.575 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 2.2 m170 -170.14 -35.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.585 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.579 ' CB ' ' CB ' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -129.19 170.35 13.67 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.56 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 31' ' ' GLU . 70.1 mt -119.09 136.97 53.88 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.218 -0.926 . . . . 0.0 110.022 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.46 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -86.6 165.96 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.514 ' CG ' ' SD ' ' B' ' 57' ' ' MET . 0.1 OUTLIER -42.84 -26.94 0.15 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.982 . . . . 0.0 109.87 -179.708 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -78.65 -49.38 13.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.208 -0.932 . . . . 0.0 110.411 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.836 ' HB3' HD22 ' B' ' 27' ' ' LEU . 37.1 mm-40 -55.98 -41.85 75.43 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.982 -1.074 . . . . 0.0 108.663 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.906 HD22 HD12 ' B' ' 60' ' ' LEU . 2.1 mt -57.61 -65.98 0.54 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.792 -0.568 . . . . 0.0 109.615 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.34 -30.96 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.367 -0.833 . . . . 0.0 109.648 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -67.91 0.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.923 . . . . 0.0 109.301 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.758 ' CD1' HD13 ' B' ' 27' ' ' LEU . 12.1 mt -45.72 -25.46 0.49 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 109.547 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.691 HD12 ' O ' ' B' ' 32' ' ' LEU . 0.7 OUTLIER -70.84 -59.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 108.91 179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -78.89 4.83 13.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 109.708 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.07 -11.11 9.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.399 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.879 ' OE1' HG13 ' B' ' 77' ' ' VAL . 5.4 tm-20 -101.94 -40.74 6.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 0.0 109.4 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.72 HD22 ' N ' ' B' ' 40' ' ' LEU . 2.7 mm? -88.22 -46.72 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.255 -0.903 . . . . 0.0 109.393 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.0 t . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.382 -0.824 . . . . 0.0 109.261 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.659 HD12 HG21 ' B' ' 36' ' ' ILE . 14.0 mm . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 6.2 mtmt 83.37 -60.12 0.13 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.639 -0.663 . . . . 0.0 109.973 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' HG2' ' B' ' 50' ' ' GLN . 5.4 pt-20 -143.88 -46.55 0.27 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.057 -1.027 . . . . 0.0 109.637 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -164.93 31.05 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.955 . . . . 0.0 109.721 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.15 -70.4 0.24 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -1.0 . . . . 0.0 109.082 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.991 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.1 t -84.11 -9.61 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.0 109.037 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HG3' ' B' ' 33' ' ' LYS . 2.2 t -82.5 -31.61 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.065 -1.022 . . . . 0.0 109.099 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 1.4 t70 -90.33 -29.57 18.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.411 -0.806 . . . . 0.0 109.191 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -84.39 -44.64 13.54 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.332 -0.855 . . . . 0.0 109.398 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 1.109 HG22 HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -68.2 -42.84 85.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 O-C-N 121.125 -0.984 . . . . 0.0 109.314 179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.514 ' SD ' ' CG ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -39.88 -55.0 2.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 110.318 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -58.44 -40.65 83.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.954 . . . . 0.0 109.323 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.678 HG21 ' SD ' ' B' ' 79' ' ' MET . 99.4 m -67.61 -20.2 65.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 110.356 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 1.109 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -82.2 -72.48 0.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.932 -1.105 . . . . 0.0 109.151 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.26 100.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 0.0 109.496 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.92 9.08 4.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.275 -0.891 . . . . 0.0 109.545 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.91 -29.78 9.27 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.936 . . . . 0.0 109.405 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.76 2.13 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -175.26 -36.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.257 -1.143 . . . . 0.0 108.521 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 -12.9 50.68 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.579 ' CB ' ' CB ' ' B' ' 26' ' ' LYS . 1.7 mm-40 -112.24 150.54 30.77 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.257 -1.143 . . . . 0.0 109.457 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.903 ' SG ' HD21 ' B' ' 32' ' ' LEU . 7.2 m -73.74 155.77 38.58 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.203 -0.936 . . . . 0.0 110.199 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.41 171.5 7.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.481 -0.762 . . . . 0.0 109.196 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.688 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -57.88 -53.63 56.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.238 -0.914 . . . . 0.0 110.672 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.495 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 1.9 pt20 -62.31 -29.99 70.83 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.23 -0.919 . . . . 0.0 108.687 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.486 ' HG2' ' HB3' ' B' ' 68' ' ' CYS . 1.1 tt0 -81.78 -15.25 54.86 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.784 ' HZ ' HD21 ' A' ' 3' ' ' LEU . 5.7 t80 -75.35 -52.3 11.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.185 -0.947 . . . . 0.0 108.938 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.819 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -66.64 -45.82 77.78 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.891 . . . . 0.0 109.188 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.09 -43.41 91.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 108.922 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.668 ' CE1' HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -49.15 -60.11 3.08 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.879 HG13 ' OE1' ' B' ' 39' ' ' GLU . 44.0 t -59.92 -25.57 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.342 -0.848 . . . . 0.0 108.714 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.857 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -60.86 -37.31 81.69 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.52 -0.737 . . . . 0.0 109.207 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.704 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 1.1 mtm -79.11 -66.79 0.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.991 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -47.95 -22.43 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 O-C-N 120.473 -1.392 . . . . 0.0 109.218 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 16.3 m -78.42 -66.44 0.85 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.059 -1.026 . . . . 0.0 108.915 178.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.8 t -81.37 -49.84 10.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.995 . . . . 0.0 108.756 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.85 -35.92 0.17 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.807 -0.558 . . . . 0.0 109.605 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 10.0 t -67.07 -52.89 36.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.367 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.49 -10.4 51.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.225 -0.922 . . . . 0.0 109.543 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -90.14 -34.56 15.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.193 -0.942 . . . . 0.0 109.493 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.901 . . . . 0.0 109.483 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.659 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.3 mp0 -73.96 -71.24 0.34 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.299 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.769 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.4 mp -61.48 -18.02 57.15 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.342 -0.849 . . . . 0.0 109.404 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.456 ' O ' ' CG ' ' A' ' 7' ' ' MET . 5.2 tt0 -68.89 -66.98 0.51 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.074 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.523 ' HA ' HG22 ' A' ' 8' ' ' VAL . 2.5 ttmt -65.49 -14.59 61.33 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.278 -0.889 . . . . 0.0 109.055 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.753 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -82.81 -29.4 29.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.332 -0.855 . . . . 0.0 109.117 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 8' ' ' VAL . 3.7 ptp -83.33 -23.77 32.39 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 109.251 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.554 HG23 ' N ' ' A' ' 9' ' ' ALA . 32.9 m -80.39 -44.33 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.261 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -71.23 -36.38 71.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.456 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.837 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -75.15 -54.18 7.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 109.626 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.837 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -46.62 -45.86 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.098 -1.001 . . . . 0.0 109.352 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.552 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -67.8 -34.17 76.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.192 -0.942 . . . . 0.0 109.583 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.03 HG11 HD21 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -73.97 -15.42 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.2 t80 -85.78 -41.88 14.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.01 -1.056 . . . . 0.0 109.281 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.459 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 10.6 m170 -74.47 -28.91 61.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.284 -0.885 . . . . 0.0 109.352 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -79.74 -60.29 2.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.911 . . . . 0.0 109.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.574 ' HB3' HD21 ' A' ' 27' ' ' LEU . 37.9 m-85 -59.0 -46.09 89.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.497 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 p -75.05 -11.94 60.21 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 109.481 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.545 ' HA3' ' CG ' ' A' ' 24' ' ' LYS . . . -94.99 26.62 18.0 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -90.06 -16.83 28.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -1.151 . . . . 0.0 109.569 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 23' ' ' ASP . 27.2 mt-10 -105.44 69.35 0.83 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.146 -0.971 . . . . 0.0 109.683 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.446 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . 39.58 28.43 0.12 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' N ' ' O ' ' A' ' 21' ' ' GLU . 11.9 t70 -179.47 137.26 0.13 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.098 -1.236 . . . . 0.0 109.662 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.545 ' CG ' ' HA3' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -108.83 112.94 25.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.304 -0.872 . . . . 0.0 109.383 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.459 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 3.0 t-80 -170.07 -35.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.642 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.54 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -145.06 170.2 16.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.814 HD23 ' C ' ' A' ' 31' ' ' GLU . 1.7 mp -117.79 128.0 54.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.236 -0.915 . . . . 0.0 110.032 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.547 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -74.26 161.39 29.97 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.005 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.547 ' N ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -28.93 0.24 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.873 -1.142 . . . . 0.0 109.488 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 28' ' ' LYS . 3.0 m -82.29 -40.73 21.11 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.376 -0.827 . . . . 0.0 110.164 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.814 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -58.64 -40.35 83.17 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.794 -1.191 . . . . 0.0 108.483 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.866 HD21 ' SG ' ' A' ' 68' ' ' CYS . 17.8 mt -62.94 -61.83 2.13 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.31 -27.22 0.14 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 109.757 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.28 -67.33 0.76 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.661 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.03 HD21 HG11 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -42.02 -30.73 0.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.424 -0.797 . . . . 0.0 110.086 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.052 HD12 HG21 ' A' ' 80' ' ' VAL . 6.0 mm -85.38 -41.86 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.187 -0.945 . . . . 0.0 109.421 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.774 HD21 HG21 ' A' ' 47' ' ' ILE . 2.2 m-80 -87.51 11.6 14.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.551 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.482 ' HB3' ' OH ' ' A' ' 17' ' ' TYR . 2.0 m-80 -118.09 -44.72 2.68 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.448 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 3' ' ' LEU . 13.8 mm-40 -109.32 -9.89 14.96 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.278 -0.889 . . . . 0.0 109.49 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.662 HD11 HG13 ' A' ' 77' ' ' VAL . 5.6 mp -119.63 41.78 3.05 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 109.471 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.3 p . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.495 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.774 HG21 HD21 ' A' ' 37' ' ' ASN . 8.6 mt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.517 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 6.4 ptmt 163.23 -34.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.286 -0.883 . . . . 0.0 109.384 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HG3' ' HG3' ' A' ' 50' ' ' GLN . 25.3 pt-20 -140.43 -38.44 0.44 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.87 . . . . 0.0 109.412 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.5 ' HG3' ' HG3' ' A' ' 49' ' ' GLU . 2.2 pt20 167.72 48.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.202 -0.936 . . . . 0.0 109.612 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.67 -70.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.178 -0.951 . . . . 0.0 109.281 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.956 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.3 t -91.63 -12.96 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.0 108.878 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.678 HG11 ' HD3' ' A' ' 33' ' ' LYS . 35.8 t -82.58 -27.51 8.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.14 -0.975 . . . . 0.0 108.84 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -90.46 -34.37 15.62 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.475 -0.766 . . . . 0.0 109.106 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -81.15 -45.15 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.342 -0.849 . . . . 0.0 109.407 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 1.067 HG22 HD21 ' A' ' 60' ' ' LEU . 1.3 p -64.9 -44.04 96.24 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.064 -1.023 . . . . 0.0 109.303 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -41.01 -47.58 3.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.584 -0.698 . . . . 0.0 109.922 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.06 -44.61 97.12 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.185 -0.947 . . . . 0.0 108.848 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 59' ' ' THR . 17.7 m -73.24 -8.95 58.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.444 -0.785 . . . . 0.0 109.608 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.067 HD21 HG22 ' A' ' 56' ' ' VAL . 2.9 mt -85.66 -74.69 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.145 -0.972 . . . . 0.0 109.388 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.71 93.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.61 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.26 13.32 34.7 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.261 -0.899 . . . . 0.0 109.412 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.02 -45.34 2.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.0 109.541 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.07 91.16 2.15 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.62 -36.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.301 -1.117 . . . . 0.0 108.492 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 39.81 2.12 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.54 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -156.38 113.39 3.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -1.157 . . . . 0.0 109.331 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' A' ' 32' ' ' LEU . 94.9 m -69.8 157.77 36.73 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.215 -0.928 . . . . 0.0 110.076 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -118.42 170.6 8.79 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.323 -0.861 . . . . 0.0 109.093 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.433 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.1 OUTLIER -50.56 -64.76 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.366 -0.834 . . . . 0.0 111.293 -179.216 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 5.4 pt20 -45.28 -27.95 0.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.039 -1.038 . . . . 0.0 108.732 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.615 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . 3.3 mt-10 -77.58 -41.8 37.51 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.501 -0.75 . . . . 0.0 110.009 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CE2' HD23 ' A' ' 10' ' ' LEU . 2.6 t80 -51.51 -50.41 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.81 -1.182 . . . . 0.0 109.016 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.851 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mtp -62.81 -38.7 91.75 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.5 -0.75 . . . . 0.0 109.347 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -69.6 -16.67 63.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.172 -0.955 . . . . 0.0 108.787 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.934 ' CD1' HD22 ' A' ' 60' ' ' LEU . 15.0 m-30 -75.14 -70.05 0.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.711 ' CG2' HD23 ' B' ' 3' ' ' LEU . 99.2 t -52.1 -29.97 12.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.056 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.906 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -62.93 -44.45 96.05 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.679 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.8 OUTLIER -76.3 -69.64 0.49 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 109.968 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 1.052 HG21 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.85 -23.38 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 O-C-N 120.575 -1.328 . . . . 0.0 109.717 -178.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.595 HG21 ' SD ' ' B' ' 7' ' ' MET . 15.7 m -80.4 -67.81 0.74 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.893 -1.129 . . . . 0.0 108.927 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.1 t -77.32 -49.72 14.37 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.95 . . . . 0.0 108.768 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.87 -30.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.408 0.623 . . . . 0.0 109.557 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.474 ' N ' ' O ' ' A' ' 82' ' ' THR . 42.9 t -89.66 -41.66 11.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.312 -0.868 . . . . 0.0 109.448 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.411 ' N ' ' O ' ' A' ' 82' ' ' THR . 36.1 t60 -63.19 -11.92 24.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.633 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' A' ' 86' ' ' GLU . 6.2 tp10 -82.06 -35.65 28.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.94 . . . . 0.0 109.442 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.3 -0.875 . . . . 0.0 109.492 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.459 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.808 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 5.2 mm-40 -64.82 -54.87 24.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.276 -0.89 . . . . 0.0 109.301 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.711 HD23 ' CG2' ' A' ' 77' ' ' VAL . 6.0 mp -70.98 -19.72 62.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.308 -0.87 . . . . 0.0 109.402 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.459 ' HB2' ' N ' ' B' ' 1' ' ' SER . 15.2 tp10 -63.05 -56.02 20.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.229 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.494 ' HD3' ' HD2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -64.69 -39.2 93.26 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.261 -0.899 . . . . 0.0 108.758 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -69.73 -16.12 63.27 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.299 -0.876 . . . . 0.0 109.106 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.946 ' CE ' HD13 ' B' ' 11' ' ' ILE . 6.5 tpt -77.23 -50.55 12.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.417 -0.802 . . . . 0.0 109.26 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.45 ' C ' HG22 ' B' ' 11' ' ' ILE . 12.2 p -65.29 -31.03 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.234 -0.916 . . . . 0.0 109.476 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.659 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -79.88 -69.76 0.56 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.932 . . . . 0.0 109.564 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.753 HD11 ' HB1' ' A' ' 6' ' ' ALA . 36.7 mt -43.91 -45.74 7.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 109.59 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.946 HD13 ' CE ' ' B' ' 7' ' ' MET . 0.5 OUTLIER -61.08 -46.66 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.204 -0.935 . . . . 0.0 109.449 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.584 ' N ' HG23 ' B' ' 11' ' ' ILE . 40.5 t0 -65.68 -15.2 62.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.276 -0.89 . . . . 0.0 109.475 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.653 HG21 ' HB2' ' A' ' 2' ' ' GLU . 2.2 t -89.7 -31.45 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 0.0 109.269 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.572 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 8.1 t80 -69.28 -46.13 67.95 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.995 -1.066 . . . . 0.0 109.123 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -78.14 -39.61 40.59 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.4 tt0 -62.92 -63.33 1.24 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 109.457 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.619 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 28.5 m-85 -53.7 -41.12 66.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.259 -0.9 . . . . 0.0 109.541 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB3' ' N ' ' B' ' 25' ' ' HIS . 1.7 m -61.51 -32.68 72.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.215 -0.928 . . . . 0.0 109.665 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.55 31.12 5.97 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.5 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 27.6 mmm180 -90.08 -30.84 17.44 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.15 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.6 mt-10 -153.71 93.99 1.73 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 109.525 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 57.99 158.16 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' C ' ' CG ' ' B' ' 24' ' ' LYS . 10.7 m-20 60.3 155.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.495 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.444 ' CG ' ' C ' ' B' ' 23' ' ' ASP . 0.9 OUTLIER -154.41 63.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.572 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -170.03 -35.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -118.98 167.27 11.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.0 109.588 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' B' ' 31' ' ' GLU . 79.6 mt -118.07 121.2 39.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.803 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.676 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.2 OUTLIER -73.08 168.13 19.7 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.179 -0.951 . . . . 0.0 108.655 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -43.34 -26.95 0.22 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.16 -0.962 . . . . 0.0 109.537 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.423 ' N ' ' O ' ' B' ' 28' ' ' LYS . 31.2 m -74.5 -62.41 1.53 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.288 -0.883 . . . . 0.0 109.975 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.936 ' HB3' HD22 ' B' ' 27' ' ' LEU . 48.2 mm-40 -45.72 -42.47 11.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.092 -1.005 . . . . 0.0 109.223 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 1.053 HD22 ' HE3' ' B' ' 57' ' ' MET . 4.3 mp -55.29 -69.44 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.601 -0.687 . . . . 0.0 109.264 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.999 ' HD3' HG11 ' B' ' 53' ' ' VAL . 4.5 mmtp -38.95 -32.47 0.09 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.465 -0.772 . . . . 0.0 109.744 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' B' ' 38' ' ' ASN . 0.3 OUTLIER -65.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.307 -0.87 . . . . 0.0 109.237 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 3' ' ' LEU . 3.9 mm? -44.43 -26.15 0.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.299 -0.875 . . . . 0.0 109.464 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.913 HG13 HG22 ' B' ' 53' ' ' VAL . 1.1 mm -75.01 -61.97 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -87.91 18.75 3.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.706 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 23.4 t-20 -114.54 -44.91 3.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -0.909 . . . . 0.0 109.261 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 18.3 mm-40 -123.46 -9.99 7.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.332 -0.855 . . . . 0.0 109.451 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' B' ' 36' ' ' ILE . 18.4 mt -109.06 52.86 0.7 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.442 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.569 179.983 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.932 ' CD1' HG21 ' B' ' 53' ' ' VAL . 42.8 mt . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.53 ' HB2' ' CG ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -86.26 61.37 6.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.224 -0.923 . . . . 0.0 109.393 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' B' ' 50' ' ' GLN . 0.5 OUTLIER 64.13 59.24 1.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.288 -0.883 . . . . 0.0 109.307 -179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 4.2 mt-30 65.33 48.93 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.324 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.53 ' CG ' ' HB2' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -88.8 -70.15 0.66 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.211 -0.931 . . . . 0.0 109.568 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 1.004 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -91.46 -12.88 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.449 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.999 HG11 ' HD3' ' B' ' 33' ' ' LYS . 75.3 t -84.34 -25.28 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.051 -1.031 . . . . 0.0 108.793 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -88.22 -33.93 17.95 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -51.28 8.23 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.429 -0.795 . . . . 0.0 108.956 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.898 ' O ' HD12 ' B' ' 60' ' ' LEU . 1.3 p -59.59 -40.61 82.54 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 O-C-N 121.208 -0.932 . . . . 0.0 108.92 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 1.053 ' HE3' HD22 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -42.17 -48.39 4.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.578 -0.701 . . . . 0.0 109.42 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.61 -43.2 99.41 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.291 -0.881 . . . . 0.0 109.071 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.417 ' O ' HG22 ' B' ' 59' ' ' THR . 8.3 m -66.27 -13.69 60.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.31 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 1.013 HD22 ' CD2' ' B' ' 32' ' ' LEU . 2.1 mp -95.29 -28.79 14.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 0.0 109.469 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.417 ' O ' ' C ' ' B' ' 62' ' ' ASN . 0.5 OUTLIER -65.46 114.32 4.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.214 -0.929 . . . . 0.0 109.535 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' B' ' 61' ' ' ASP . 0.4 OUTLIER -44.31 -37.65 3.42 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 0.0 109.363 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 179.29 32.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.0 109.675 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 93.44 1.71 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.52 -35.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.339 -1.095 . . . . 0.0 108.446 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 101.36 38.61 3.23 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.504 ' CB ' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -143.5 104.39 4.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -1.134 . . . . 0.0 109.425 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.521 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.6 t -69.69 156.54 38.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.858 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.5 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -115.46 171.61 7.61 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.483 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -59.03 -50.84 72.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.156 -0.965 . . . . 0.0 110.357 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.491 ' HB3' ' CE ' ' A' ' 79' ' ' MET . 0.9 OUTLIER -56.24 -39.4 72.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.254 -0.904 . . . . 0.0 109.161 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.505 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -79.59 -16.07 56.52 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.463 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.538 ' CZ ' HG12 ' B' ' 13' ' ' VAL . 54.3 t80 -69.46 -56.3 7.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.224 -0.922 . . . . 0.0 108.705 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.906 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 10.7 mtt -63.74 -49.32 73.48 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.44 -26.36 65.13 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.304 -0.872 . . . . 0.0 108.963 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.663 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.1 OUTLIER -64.6 -70.59 0.22 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.408 -0.807 . . . . 0.0 108.862 179.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.577 HG21 ' CD2' ' A' ' 3' ' ' LEU . 87.9 t -56.42 -20.61 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.25 -0.906 . . . . 0.0 108.958 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -64.25 -54.38 34.22 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.46 -0.775 . . . . 0.0 109.423 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.633 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.4 OUTLIER -68.24 -61.36 1.88 Allowed 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.345 -0.847 . . . . 0.0 109.652 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 1.004 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -48.43 -22.08 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.361 -1.462 . . . . 0.0 109.376 -179.402 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 3.6 m -79.23 -69.94 0.54 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.039 -1.038 . . . . 0.0 109.185 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.8 t -73.82 -49.17 26.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.063 -1.023 . . . . 0.0 109.227 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.55 -43.84 0.42 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.756 -0.59 . . . . 0.0 109.893 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.53 -50.33 71.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.469 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -10.12 49.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.295 -0.878 . . . . 0.0 109.53 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 82' ' ' THR . 20.9 mt-10 -73.72 -19.02 60.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 109.539 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 24.3 t80 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.216 -0.928 . . . . 0.0 109.512 179.982 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.28 0.562 . . . . 0.0 109.487 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.705 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -64.05 -70.82 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.225 -0.922 . . . . 0.0 109.525 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.069 HD13 HD23 ' B' ' 10' ' ' LEU . 3.7 mm? -75.37 -32.5 60.85 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.468 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.0 OUTLIER -60.25 -60.29 4.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.272 -0.892 . . . . 0.0 109.559 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -63.07 -30.51 71.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -0.914 . . . . 0.0 109.507 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.725 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -75.4 -18.12 60.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.484 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.454 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 42.4 ttm -80.93 -48.88 11.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.459 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 42.5 t -68.29 -29.62 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 109.508 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -69.9 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.597 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.567 ' CD2' HD23 ' B' ' 3' ' ' LEU . 13.2 mt -46.0 -47.01 16.8 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 0.0 109.559 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.891 HD11 HG21 ' B' ' 81' ' ' THR . 12.3 mt -60.39 -41.16 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.933 . . . . 0.0 109.491 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.499 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 37.6 t0 -63.03 -21.4 66.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.493 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.027 HG21 HD11 ' B' ' 3' ' ' LEU . 2.3 t -84.11 -31.37 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.928 . . . . 0.0 109.391 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 15.1 t80 -68.0 -44.66 76.08 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.017 -1.052 . . . . 0.0 109.21 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.515 ' CD2' ' HD3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -80.83 -41.13 23.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.296 -0.877 . . . . 0.0 109.501 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.499 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 9.8 tt0 -60.16 -61.63 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.95 . . . . 0.0 109.443 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.656 ' CG ' HD21 ' A' ' 35' ' ' LEU . 32.7 m-85 -57.28 -50.66 72.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' ' HA ' ' A' ' 24' ' ' LYS . 38.1 t -61.24 -18.72 59.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.618 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -64.68 -31.8 82.1 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.428 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -70.3 -43.38 70.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.273 -1.134 . . . . 0.0 109.481 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 28' ' ' LYS . 22.2 tp10 -97.06 135.04 39.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.263 -0.898 . . . . 0.0 109.442 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 52.85 -145.78 19.46 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.458 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 0.4 OUTLIER -80.38 -74.65 0.3 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -1.137 . . . . 0.0 109.491 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HD3' ' CD2' ' A' ' 15' ' ' HIS . 0.0 OUTLIER 168.79 46.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 109.424 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.32 -14.72 7.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.0 109.695 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' CG ' ' HB3' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -149.04 170.08 19.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 0.0 109.613 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.904 HD22 ' HB3' ' A' ' 31' ' ' GLU . 96.4 mt -118.01 127.08 53.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.776 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 4.3 tttp -69.81 152.89 44.05 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' N ' ' A' ' 30' ' ' SER . 4.2 ptpt -37.14 -30.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.453 -0.779 . . . . 0.0 109.847 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.51 ' N ' ' HG3' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -74.97 -50.9 15.11 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.247 -0.908 . . . . 0.0 109.38 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.904 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.1 mp0 -49.91 -43.81 49.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 108.905 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.948 HD12 ' SD ' ' A' ' 57' ' ' MET . 31.3 mt -57.15 -66.82 0.39 Allowed 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.673 -0.642 . . . . 0.0 109.275 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.958 ' HG2' HG11 ' A' ' 53' ' ' VAL . 2.5 mttp -41.35 -31.35 0.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -0.835 . . . . 0.0 109.779 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -64.54 -68.61 0.34 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.18 -0.95 . . . . 0.0 109.35 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.656 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.1 mm? -44.04 -44.79 7.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.693 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -53.4 -48.09 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.202 -0.937 . . . . 0.0 109.631 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' C ' ' A' ' 38' ' ' ASN . 3.2 m120 -73.97 -67.26 0.62 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.111 -0.993 . . . . 0.0 110.055 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.441 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.5 OUTLIER -40.83 -70.49 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.442 -0.786 . . . . 0.0 110.269 -179.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 77' ' ' VAL . 31.5 tt0 -67.59 -51.8 46.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.174 -0.954 . . . . 0.0 110.026 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.57 HD21 ' CA ' ' A' ' 81' ' ' THR . 2.4 mp -98.15 65.85 1.76 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.199 -0.938 . . . . 0.0 109.572 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.321 -0.862 . . . . 0.0 109.606 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.555 ' CD1' HG21 ' A' ' 53' ' ' VAL . 1.5 mt . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -43.03 -27.15 0.18 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.3 -0.875 . . . . 0.0 109.562 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.52 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 1.5 mm-40 164.23 63.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.398 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 2.9 mm-40 51.62 48.82 22.15 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.253 -0.905 . . . . 0.0 109.329 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -87.49 -70.07 0.65 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.588 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -88.16 -22.42 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.226 -0.921 . . . . 0.0 109.601 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.958 HG11 ' HG2' ' A' ' 33' ' ' LYS . 78.8 t -78.9 -29.93 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.068 -1.02 . . . . 0.0 109.262 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 19.5 t0 -77.12 -49.31 15.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.272 -0.892 . . . . 0.0 109.221 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -50.35 51.37 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.662 ' O ' HG22 ' A' ' 59' ' ' THR . 1.9 p -58.43 -49.35 82.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.09 -1.007 . . . . 0.0 109.072 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.948 ' SD ' HD12 ' A' ' 32' ' ' LEU . 8.5 tpt -41.53 -44.31 2.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.79 . . . . 0.0 109.802 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 26.1 mt-10 -57.01 -48.19 79.06 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.23 -0.919 . . . . 0.0 109.424 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.861 HG21 ' CE ' ' A' ' 79' ' ' MET . 4.7 t -76.23 -9.7 58.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.278 -0.889 . . . . 0.0 109.977 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.651 HD11 ' CD1' ' A' ' 76' ' ' PHE . 16.7 mt -87.27 3.05 48.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.491 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 61' ' ' ASP . 17.8 p-10 -85.46 114.59 22.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.17 -0.956 . . . . 0.0 109.47 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -52.45 -22.0 4.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.506 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 176.99 40.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.91 . . . . 0.0 109.472 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.419 ' O ' ' CG ' ' A' ' 65' ' ' ASP . . . 77.63 90.36 0.32 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 176.28 -32.46 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.277 -1.131 . . . . 0.0 108.579 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.12 -22.36 23.16 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mm-40 -70.01 106.94 3.4 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -1.115 . . . . 0.0 109.389 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 14.2 t -69.92 157.08 38.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 109.679 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.506 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 34.3 t0 -117.58 171.26 8.13 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -58.74 -50.3 74.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.479 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 2.3 mp0 -56.81 -40.22 75.57 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.819 . . . . 0.0 108.983 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 mt-10 -76.63 -17.15 59.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.428 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.476 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 26.4 t80 -71.54 -49.56 39.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.19 -0.944 . . . . 0.0 108.966 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.936 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mmt -66.04 -54.31 27.45 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.312 -0.867 . . . . 0.0 109.034 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.63 -26.3 66.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.24 -0.913 . . . . 0.0 108.999 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CD1' HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.25 -68.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 39' ' ' GLU . 53.4 t -62.75 -20.53 25.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.835 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -69.19 -30.86 69.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.447 -0.783 . . . . 0.0 109.269 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.861 ' CE ' HG21 ' A' ' 59' ' ' THR . 20.7 mtp -85.47 -67.53 0.8 Allowed 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.838 0.827 . . . . 0.0 109.072 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.946 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.15 -22.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 O-C-N 120.4 -1.438 . . . . 0.0 109.505 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.57 ' CA ' HD21 ' A' ' 40' ' ' LEU . 45.2 m -85.15 -61.1 1.85 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.007 -1.058 . . . . 0.0 108.468 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.554 HG21 ' CB ' ' B' ' 70' ' ' PHE . 1.4 m -80.28 -55.27 5.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.32 -42.12 0.19 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.276 0.56 . . . . 0.0 109.933 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 87' ' ' PHE . 30.4 t -69.03 -58.88 3.51 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.912 . . . . 0.0 109.463 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.421 ' C ' ' O ' ' A' ' 84' ' ' CYS . 2.1 t60 -44.5 -64.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -49.12 -36.02 17.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.45 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.309 -0.869 . . . . 0.0 109.474 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.489 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 58.4 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.73 -74.9 0.08 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.291 -0.881 . . . . 0.0 109.488 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 1.027 HD11 HG21 ' A' ' 13' ' ' VAL . 3.3 mp -71.16 -28.08 64.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.941 . . . . 0.0 109.488 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.489 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 34.4 tt0 -58.13 -58.3 9.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.394 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -59.49 -50.97 71.85 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.88 . . . . 0.0 109.336 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.655 ' O ' HD12 ' B' ' 10' ' ' LEU . . . -61.88 -14.78 37.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.447 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.473 ' HG3' ' OE2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -76.39 -53.64 7.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.425 ' H ' HG23 ' B' ' 8' ' ' VAL . 2.7 t -62.62 -27.69 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.705 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -80.17 -69.86 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 1.069 HD23 HD13 ' A' ' 3' ' ' LEU . 12.1 mt -44.4 -53.17 7.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 109.487 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.752 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 22.1 mm -55.61 -58.22 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 109.886 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -51.4 -19.92 1.56 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.034 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 1.002 HG13 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -88.58 -36.28 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.034 -1.041 . . . . 0.0 109.595 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.553 ' CD1' ' HB2' ' B' ' 73' ' ' PHE . 27.3 t80 -58.86 -41.64 87.49 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.777 -1.202 . . . . 0.0 108.837 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' B' ' 16' ' ' GLN . 0.3 OUTLIER -80.7 -46.25 15.84 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.334 -0.853 . . . . 0.0 109.252 179.727 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' B' ' 15' ' ' HIS . 1.7 tt0 -44.72 -40.17 5.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 108.685 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.521 ' O ' ' N ' ' B' ' 19' ' ' GLY . 3.9 m-85 -91.36 -79.23 0.37 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.546 ' HA ' HD23 ' B' ' 27' ' ' LEU . 32.2 t 37.0 29.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.242 0.544 . . . . 0.0 110.042 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' B' ' 31' ' ' GLU . . . 74.79 51.78 7.66 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -63.49 -10.01 15.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.328 -1.101 . . . . 0.0 109.814 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -93.18 69.91 4.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.998 . . . . 0.0 109.382 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.92 -42.16 1.49 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.459 ' O ' ' O ' ' B' ' 19' ' ' GLY . 1.1 m-20 -141.36 -153.3 0.45 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -1.174 . . . . 0.0 109.455 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.431 ' C ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -176.75 43.13 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.541 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.47 ' N ' ' OG ' ' B' ' 18' ' ' SER . 0.7 OUTLIER -122.44 -16.61 7.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.264 -0.897 . . . . 0.0 109.688 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.07 170.21 7.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.263 -0.898 . . . . 0.0 109.349 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' B' ' 18' ' ' SER . 12.6 mt -84.94 137.96 32.79 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 2.0 ptmt -109.67 73.12 0.83 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.225 -0.922 . . . . 0.0 109.504 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.4 tttm 61.54 -85.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.4 -0.813 . . . . 0.0 110.037 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 1.7 t -45.63 -39.43 7.75 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.134 -0.978 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.532 ' HB3' HD22 ' B' ' 27' ' ' LEU . 3.2 mm-40 -47.96 -50.12 28.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.94 -1.1 . . . . 0.0 108.745 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.756 HD21 ' CE2' ' B' ' 76' ' ' PHE . 1.1 mt -59.14 -55.76 30.89 Favored 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.712 ' HD3' HG11 ' B' ' 53' ' ' VAL . 7.7 mttp -42.56 -33.82 0.76 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.436 -0.79 . . . . 0.0 109.595 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -71.7 -66.14 0.67 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.683 -179.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 1.002 HD21 HG13 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -41.98 -60.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.363 -0.835 . . . . 0.0 110.231 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.527 ' HA ' ' CD1' ' B' ' 40' ' ' LEU . 80.7 mt -57.4 -53.55 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.326 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.643 HD21 HG21 ' B' ' 53' ' ' VAL . 0.7 OUTLIER -83.39 15.99 2.75 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.132 -0.98 . . . . 0.0 110.36 -179.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.527 ' N ' ' O ' ' B' ' 34' ' ' GLU . 22.6 t30 -135.7 4.28 3.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.531 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 4.7 mp0 -133.19 -37.31 0.98 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.101 -0.999 . . . . 0.0 109.49 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.527 ' CD1' ' HA ' ' B' ' 36' ' ' ILE . 5.4 mp -75.7 -54.71 6.53 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.15 -0.969 . . . . 0.0 109.407 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.465 0 O-C-N 121.293 -0.88 . . . . 0.0 109.223 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.71 HD13 ' HB ' ' B' ' 53' ' ' VAL . 1.6 mt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.6 ptpt -43.35 -32.48 0.83 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.522 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' B' ' 49' ' ' GLU . 4.0 pt-20 179.01 54.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.258 -0.901 . . . . 0.0 109.498 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.597 ' HA ' HG21 ' B' ' 47' ' ' ILE . 1.8 mt-30 48.45 53.8 11.46 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' B' ' 55' ' ' LYS . 0.5 OUTLIER -90.21 -70.09 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.285 -0.884 . . . . 0.0 109.798 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 1.025 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -86.49 -20.2 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 109.75 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.712 HG11 ' HD3' ' B' ' 33' ' ' LYS . 25.4 t -80.71 -36.92 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.056 -1.027 . . . . 0.0 108.892 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.538 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 36.6 t70 -81.6 -28.84 33.55 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.009 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 0.9 OUTLIER -77.66 -43.32 31.7 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.339 -0.85 . . . . 0.0 109.238 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.788 HG13 ' O ' ' B' ' 52' ' ' VAL . 15.8 m -57.04 -51.76 64.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 121.181 -0.949 . . . . 0.0 109.656 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.559 ' N ' HG23 ' B' ' 56' ' ' VAL . 1.7 tpt -40.19 -28.42 0.06 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.116 -0.99 . . . . 0.0 109.752 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' B' ' 56' ' ' VAL . 3.7 mt-10 -77.91 -48.4 16.45 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.065 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.48 ' O ' ' C ' ' B' ' 60' ' ' LEU . 38.8 m -74.55 -63.16 1.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.292 -0.88 . . . . 0.0 109.354 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 1.077 HD22 ' CD1' ' B' ' 76' ' ' PHE . 10.5 mt -34.95 -36.81 0.06 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.298 0.57 . . . . 0.0 110.128 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' B' ' 59' ' ' THR . 10.3 t70 -81.89 73.58 8.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 -87.57 -27.04 22.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.88 . . . . 0.0 109.489 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -82.25 -51.5 7.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.902 . . . . 0.0 109.488 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.97 90.72 2.13 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -175.49 -35.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -1.146 . . . . 0.0 108.595 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.62 38.46 2.22 Favored Glycine 0 N--CA 1.485 1.964 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NZ ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -153.63 108.06 3.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.315 -1.109 . . . . 0.0 109.493 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.545 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 75.1 m -69.64 156.06 39.54 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.342 -0.849 . . . . 0.0 109.898 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.455 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 8.5 m-20 -117.43 170.29 8.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.358 -0.839 . . . . 0.0 108.944 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.752 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -48.83 -67.43 0.27 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 111.319 -179.385 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.522 ' NE2' ' HG2' ' B' ' 72' ' ' GLU . 1.5 pp0? -44.21 -27.81 0.45 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.21 -0.931 . . . . 0.0 108.955 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.612 ' O ' ' CD1' ' B' ' 76' ' ' PHE . 4.6 mt-10 -77.38 -43.2 33.6 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.407 -0.808 . . . . 0.0 109.809 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.879 ' HE1' HD22 ' B' ' 35' ' ' LEU . 12.6 t80 -49.15 -49.18 43.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.925 -1.11 . . . . 0.0 108.988 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.835 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 6.4 mtt -64.0 -41.31 97.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.437 -0.789 . . . . 0.0 109.381 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -66.42 -16.3 63.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.269 -0.894 . . . . 0.0 108.747 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 1.077 ' CD1' HD22 ' B' ' 60' ' ' LEU . 13.3 m-30 -75.5 -70.25 0.44 Allowed 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD12 ' A' ' 3' ' ' LEU . 39.4 t -52.64 -24.89 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.936 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -64.4 -48.04 76.91 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.37 -0.831 . . . . 0.0 109.36 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.681 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 67.0 mtp -74.74 -67.54 0.63 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -0.888 . . . . 0.0 109.841 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 1.025 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.99 -23.44 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 120.435 -1.416 . . . . 0.0 109.704 -178.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.891 HG21 HD11 ' A' ' 11' ' ' ILE . 7.8 m -80.28 -68.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.906 -1.121 . . . . 0.0 108.795 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.5 t -77.65 -49.33 14.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.179 -0.951 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.46 -37.1 0.18 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.261 0.553 . . . . 0.0 109.791 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 3.1 t -90.05 -35.34 15.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 0.0 109.505 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.0 OUTLIER -65.79 -9.99 33.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -70.68 -21.06 62.63 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 t80 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.249 -0.907 . . . . 0.0 109.504 179.994 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.838 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -70.22 -51.94 27.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.296 -0.878 . . . . 0.0 109.306 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.012 HD22 ' OE1' ' B' ' 39' ' ' GLU . 2.0 mp -72.41 -29.45 63.74 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 7' ' ' MET . 1.2 tt0 -58.74 -64.5 0.91 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.197 -0.939 . . . . 0.0 109.312 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -43.57 98.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.208 -0.932 . . . . 0.0 109.265 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -68.41 -9.99 52.19 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.448 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.471 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -83.64 -52.71 6.22 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.917 . . . . 0.0 109.403 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.01 -20.36 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.862 . . . . 0.0 109.444 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.515 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -83.59 -60.21 2.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.213 -0.93 . . . . 0.0 109.639 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.869 HD22 HD23 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -54.7 -38.46 67.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.591 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.741 HD11 HG21 ' B' ' 81' ' ' THR . 36.6 mt -68.17 -57.71 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.566 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -56.49 -19.05 13.52 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.277 -0.889 . . . . 0.0 109.46 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.896 HG11 HD21 ' B' ' 3' ' ' LEU . 0.8 OUTLIER -88.38 -29.9 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.138 -0.977 . . . . 0.0 109.253 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 73' ' ' PHE . 6.0 t80 -66.2 -41.4 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.051 -1.03 . . . . 0.0 109.075 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.658 ' CE1' ' CD2' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -78.46 -43.42 27.21 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.884 . . . . 0.0 109.388 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.63 -55.65 20.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -0.925 . . . . 0.0 109.447 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.518 ' HE1' HG22 ' A' ' 13' ' ' VAL . 20.9 m-85 -60.4 -43.75 96.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 109.532 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 5.5 p -56.92 -22.12 35.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.47 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.467 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -71.23 -35.93 63.78 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 19' ' ' GLY . 42.0 mmm-85 -43.96 -47.14 8.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -1.108 . . . . 0.0 109.464 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' A' ' 22' ' ' GLY . 3.4 tm-20 -70.42 154.67 41.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.461 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.23 -26.41 0.92 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.67 -149.8 0.18 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -174.26 65.6 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.275 -0.891 . . . . 0.0 109.425 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.658 ' CD2' ' CE1' ' A' ' 15' ' ' HIS . 7.3 m80 -169.28 -35.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.576 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' N ' ' HB2' ' A' ' 18' ' ' SER . 22.6 mtmt -129.34 159.6 35.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -0.906 . . . . 0.0 109.492 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.963 HD23 ' C ' ' A' ' 31' ' ' GLU . 7.3 mp -95.2 167.11 11.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 109.454 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -134.39 79.95 1.83 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.552 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.721 ' H ' HD13 ' A' ' 32' ' ' LEU . 4.1 ttmt 61.81 -85.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 110.3 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.428 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 6.8 m -44.68 -49.65 10.3 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 0.0 110.435 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.963 ' C ' HD23 ' A' ' 27' ' ' LEU . 63.9 mm-40 -63.11 -34.46 77.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.029 -1.045 . . . . 0.0 109.716 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.113 HD23 HD13 ' A' ' 60' ' ' LEU . 1.9 mp -61.37 -70.19 0.2 Allowed 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.434 -0.791 . . . . 0.0 109.674 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 9.1 ttmt -42.43 -39.28 2.16 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.332 -0.855 . . . . 0.0 109.75 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -58.7 -56.64 19.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.8 HD21 HG13 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -46.85 -35.27 6.16 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 109.476 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.62 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 1.2 mp -72.31 -39.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.592 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 57.0 m-80 -78.66 -1.75 35.86 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.185 -0.947 . . . . 0.0 109.809 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.513 ' ND2' ' OH ' ' A' ' 17' ' ' TYR . 21.0 t-20 -107.45 -25.02 11.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.593 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.629 ' OE1' HD22 ' A' ' 40' ' ' LEU . 3.1 tm-20 -99.42 -44.97 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -0.929 . . . . 0.0 109.505 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.972 HD11 ' HA ' ' A' ' 81' ' ' THR . 3.6 mm? -56.11 -44.92 79.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.217 -0.927 . . . . 0.0 109.407 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.509 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.545 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.761 HD13 HG21 ' A' ' 53' ' ' VAL . 3.9 mp . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.3 0.571 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 pttt -149.57 -48.7 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.474 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.489 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 87.9 mt-10 -64.81 -10.84 31.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.365 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 0.8 OUTLIER 75.29 54.28 0.07 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.292 -0.88 . . . . 0.0 109.448 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.83 -70.4 0.68 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.251 -0.906 . . . . 0.0 109.606 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.914 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.2 t -92.03 -24.78 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.112 -0.993 . . . . 0.0 109.251 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.761 HG21 HD13 ' A' ' 47' ' ' ILE . 39.2 t -78.58 -18.57 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.0 109.36 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.6 t0 -87.69 -37.67 16.5 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.239 -0.913 . . . . 0.0 109.44 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -78.81 -39.21 36.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.782 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.0 m -65.08 -46.16 92.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -43.51 -25.74 0.17 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.117 -0.989 . . . . 0.0 110.144 -179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.8 OUTLIER -86.39 -47.15 9.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.074 -1.016 . . . . 0.0 109.892 -179.632 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 1.01 HG21 ' HE3' ' A' ' 79' ' ' MET . 7.2 t -68.98 -9.76 53.92 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.226 -0.921 . . . . 0.0 109.828 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.113 HD13 HD23 ' A' ' 32' ' ' LEU . 6.7 mt -94.4 -68.57 0.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.504 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 57' ' ' MET . 49.7 p-10 -65.03 87.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.495 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -82.94 -9.34 59.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.15 -22.43 16.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.235 -0.916 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 79.9 69.14 1.42 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 26.6 t70 178.36 32.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.287 -1.125 . . . . 0.0 108.374 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.43 64.89 3.08 Favored Glycine 0 N--CA 1.482 1.721 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 6.0 mt-10 -143.9 84.81 1.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.317 -1.108 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 69' ' ' ASP . 16.0 t -69.95 157.08 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 109.724 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.84 171.85 7.78 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.753 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.33 -51.35 70.3 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.248 -0.907 . . . . 0.0 110.412 -179.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 72' ' ' GLU . 17.6 pt20 -57.27 -40.32 77.46 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.229 -0.92 . . . . 0.0 108.802 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mt-10 -77.36 -16.17 59.02 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.467 -0.77 . . . . 0.0 109.349 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 14' ' ' PHE . 56.9 t80 -70.38 -64.19 0.94 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.929 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 2.7 tpp -58.11 -43.38 87.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.2 -28.03 69.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.439 -0.788 . . . . 0.0 109.126 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.62 ' CZ ' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -62.34 -69.8 0.24 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 108.797 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.3 t -57.07 -22.78 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.975 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -57.69 -52.76 64.1 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.508 -0.745 . . . . 0.0 109.418 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 1.01 ' HE3' HG21 ' A' ' 59' ' ' THR . 0.7 OUTLIER -73.94 -63.26 1.25 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.436 -0.79 . . . . 0.0 109.923 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.914 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -47.88 -22.14 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 O-C-N 120.314 -1.492 . . . . 0.0 109.378 -179.14 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.972 ' HA ' HD11 ' A' ' 40' ' ' LEU . 4.5 m -79.1 -67.77 0.72 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.01 -1.056 . . . . 0.0 108.863 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.57 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -79.43 -49.43 12.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.135 -0.978 . . . . 0.0 108.837 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.85 -34.88 0.12 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.678 -0.639 . . . . 0.0 109.694 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 30.7 t -82.31 -46.13 14.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.493 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -47.03 -25.11 0.75 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.232 -0.918 . . . . 0.0 109.49 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.55 -50.7 13.26 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 0.0 109.508 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.183 -0.948 . . . . 0.0 109.54 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.515 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -64.37 -78.66 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.894 . . . . 0.0 109.769 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.896 HD21 HG11 ' A' ' 13' ' ' VAL . 90.0 mt -63.01 -25.24 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.126 -0.983 . . . . 0.0 109.892 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.52 ' O ' ' CG ' ' B' ' 7' ' ' MET . 1.0 OUTLIER -69.8 -70.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.127 -0.983 . . . . 0.0 109.537 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -60.28 -17.7 44.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 109.466 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.704 ' HB1' HD23 ' A' ' 10' ' ' LEU . . . -85.79 -26.81 25.57 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -0.921 . . . . 0.0 109.765 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.546 ' O ' HD12 ' B' ' 11' ' ' ILE . 3.4 ptt? -78.87 -31.74 45.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.128 -0.983 . . . . 0.0 109.474 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.521 ' N ' ' HG3' ' B' ' 7' ' ' MET . 56.0 t -82.39 -39.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.202 -0.936 . . . . 0.0 109.386 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.838 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -66.85 -42.95 84.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.24 -0.913 . . . . 0.0 109.41 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.584 HD13 ' HB1' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -68.65 -62.56 1.33 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.671 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 85.7 mt -44.98 -41.75 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.181 -0.95 . . . . 0.0 109.209 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.515 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 23.0 t0 -58.83 -61.81 2.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.311 -0.868 . . . . 0.0 109.364 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.54 -25.45 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.337 -0.852 . . . . 0.0 109.434 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 4.3 t80 -72.32 -49.69 32.54 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.927 -1.108 . . . . 0.0 109.344 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -75.91 -9.99 59.06 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 110.013 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.515 ' CG ' ' O ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -90.2 -61.69 1.63 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.047 -1.033 . . . . 0.0 109.319 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.586 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 34.2 m-85 -57.98 -43.77 86.71 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.573 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.701 ' N ' HD21 ' B' ' 27' ' ' LEU . 2.7 p -74.64 -14.01 60.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.508 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.545 ' CA ' ' HG2' ' B' ' 24' ' ' LYS . . . -92.54 8.98 76.65 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.502 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 54.7 mtp85 -87.81 -59.88 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -1.15 . . . . 0.0 109.396 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.2 OUTLIER -80.33 170.11 16.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.298 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' B' ' 23' ' ' ASP . . . -52.01 89.46 0.01 OUTLIER Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' B' ' 22' ' ' GLY . 0.5 OUTLIER 162.39 -164.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -1.084 . . . . 0.0 109.365 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.545 ' HG2' ' CA ' ' B' ' 19' ' ' GLY . 0.0 OUTLIER 171.05 58.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.236 -0.915 . . . . 0.0 109.458 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 16.5 t60 -170.27 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.302 -0.874 . . . . 0.0 109.643 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.551 ' CE ' ' HB3' ' B' ' 67' ' ' GLU . 1.4 ptmt -127.03 166.03 18.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.202 -0.936 . . . . 0.0 109.574 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.701 HD21 ' N ' ' B' ' 18' ' ' SER . 20.7 mt -121.16 130.62 53.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.265 -0.897 . . . . 0.0 109.859 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' B' ' 29' ' ' LYS . 5.0 ttpt -69.6 155.54 40.33 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -39.98 -38.68 0.74 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.185 -0.947 . . . . 0.0 109.732 -179.464 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.33 -46.15 71.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.324 -0.86 . . . . 0.0 109.582 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.525 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -53.03 -44.62 67.5 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.021 -1.049 . . . . 0.0 108.352 179.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.702 ' CD1' HD22 ' B' ' 60' ' ' LEU . 3.6 mm? -51.78 -70.71 0.08 Allowed 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.615 ' HE3' HG21 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -37.28 -33.11 0.05 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.731 -0.606 . . . . 0.0 110.146 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.448 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -69.84 -61.03 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.137 -0.977 . . . . 0.0 109.635 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -53.04 -20.6 3.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.332 -0.855 . . . . 0.0 110.052 -179.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 1.055 HD12 HG22 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -82.42 -49.06 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.047 -1.033 . . . . 0.0 109.391 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.77 0.05 19.31 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.182 -0.949 . . . . 0.0 109.462 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.455 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 0.6 OUTLIER -118.73 -22.33 7.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.163 -0.96 . . . . 0.0 109.576 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 1.012 ' OE1' HD22 ' A' ' 3' ' ' LEU . 18.5 pt-20 -91.59 -45.07 8.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 1.0 HD22 ' CG ' ' B' ' 39' ' ' GLU . 0.8 OUTLIER -84.19 -50.6 7.75 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 108.616 179.348 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.423 ' OG ' ' C ' ' B' ' 40' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.591 -0.693 . . . . 0.0 109.657 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 1.006 HD13 HG23 ' B' ' 53' ' ' VAL . 12.0 mt . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 121.248 0.547 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.2 pttt -44.85 -27.38 0.51 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.215 -0.928 . . . . 0.0 108.819 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' B' ' 48' ' ' LYS . 10.5 pt-20 178.08 -32.23 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.494 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -165.05 28.02 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.388 -0.82 . . . . 0.0 109.251 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -69.16 -70.77 0.25 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.43 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 1.018 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -91.03 -9.89 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.11 -0.994 . . . . 0.0 109.009 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.055 HG22 HD12 ' B' ' 36' ' ' ILE . 10.6 t -84.85 -29.67 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.494 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 17.9 t0 -90.15 -28.88 18.64 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -84.93 -49.81 8.03 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.442 -0.786 . . . . 0.0 109.105 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.77 ' O ' HD12 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -63.06 -41.52 93.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.132 -0.98 . . . . 0.0 108.754 179.578 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.496 ' HB2' ' O ' ' B' ' 53' ' ' VAL . 0.9 OUTLIER -43.06 -46.09 5.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.481 -0.762 . . . . 0.0 109.238 179.605 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -60.66 -48.25 82.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.227 -0.92 . . . . 0.0 109.009 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.4 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 4.0 m -64.36 -13.95 53.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.352 -0.843 . . . . 0.0 109.196 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.788 HD21 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mp -92.25 -81.41 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.336 -0.853 . . . . 0.0 109.494 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.461 ' HA ' ' O ' ' B' ' 67' ' ' GLU . 46.1 p-10 -59.17 89.17 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' B' ' 60' ' ' LEU . 0.2 OUTLIER -103.01 -1.66 28.9 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.621 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.434 ' HB2' ' OE2' ' B' ' 67' ' ' GLU . 0.7 OUTLIER -81.54 -9.34 59.71 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.118 -0.989 . . . . 0.0 109.488 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.39 81.85 0.43 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.72 -32.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.242 -1.152 . . . . 0.0 108.635 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.08 37.34 1.84 Allowed Glycine 0 N--CA 1.486 1.981 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.551 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -129.61 149.25 51.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.258 -1.142 . . . . 0.0 109.467 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 10.2 t -95.58 155.61 16.67 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.699 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' B' ' 72' ' ' GLU . 17.2 t70 -121.39 171.18 8.95 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.671 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -60.26 -54.29 47.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.135 -0.978 . . . . 0.0 110.334 -179.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.779 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 1.9 pt20 -56.55 -21.72 28.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.086 -1.009 . . . . 0.0 108.815 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' B' ' 76' ' ' PHE . 14.9 mm-40 -84.61 -30.46 24.94 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.559 -0.713 . . . . 0.0 109.159 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.736 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 37.1 t80 -62.85 -47.03 85.14 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.407 -0.808 . . . . 0.0 109.083 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.975 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 3.1 mtt -70.33 -56.63 6.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.348 -0.845 . . . . 0.0 109.301 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.43 -16.08 21.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 108.928 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.788 ' HB2' HD21 ' B' ' 60' ' ' LEU . 2.5 t80 -72.49 -68.99 0.43 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.512 -0.742 . . . . 0.0 109.137 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.634 HG21 HD23 ' A' ' 3' ' ' LEU . 42.7 t -56.1 -27.92 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.259 -0.901 . . . . 0.0 109.162 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.929 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.16 -36.46 81.85 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.378 -0.826 . . . . 0.0 109.5 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.624 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.0 OUTLIER -77.08 -68.16 0.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 109.557 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 1.018 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.41 -24.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 O-C-N 120.606 -1.309 . . . . 0.0 109.068 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.741 HG21 HD11 ' A' ' 11' ' ' ILE . 8.8 m -76.77 -69.19 0.53 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.142 -0.974 . . . . 0.0 109.395 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.4 t -75.34 -49.55 18.76 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.04 -1.037 . . . . 0.0 108.922 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.38 -30.33 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.761 -0.587 . . . . 0.0 109.775 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' B' ' 82' ' ' THR . 15.7 t -81.4 -46.65 14.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.304 -0.872 . . . . 0.0 109.604 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.0 OUTLIER -67.36 -9.85 45.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -83.99 -15.78 46.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 109.598 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.892 . . . . 0.0 109.605 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.277 0.56 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.763 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 2.9 mm-40 -68.76 -48.94 62.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.241 -0.912 . . . . 0.0 109.272 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.915 HD11 HD21 ' B' ' 35' ' ' LEU . 5.5 mt -78.99 -23.3 44.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.31 -0.869 . . . . 0.0 109.423 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.71 -61.99 2.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.127 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.44 -41.72 96.4 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.292 -0.88 . . . . 0.0 109.183 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.526 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -70.94 -10.77 60.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.385 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.614 ' CE ' HD13 ' B' ' 40' ' ' LEU . 2.7 mtp -82.07 -54.84 4.97 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.197 -0.939 . . . . 0.0 109.289 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.503 ' HA ' HD12 ' A' ' 11' ' ' ILE . 31.5 t -62.21 -32.76 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.328 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.91 ' HB1' ' HG2' ' B' ' 2' ' ' GLU . . . -73.17 -65.9 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.272 -0.892 . . . . 0.0 109.527 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.707 ' CD2' HD23 ' B' ' 3' ' ' LEU . 4.7 mt -44.47 -34.53 2.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.207 -0.933 . . . . 0.0 109.335 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.503 HD12 ' HA ' ' A' ' 8' ' ' VAL . 54.6 mt -63.39 -52.24 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.921 . . . . 0.0 109.361 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.53 -19.81 40.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.229 -0.919 . . . . 0.0 109.222 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.91 HG11 HD21 ' B' ' 3' ' ' LEU . 1.3 t -83.4 -29.78 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.338 -0.851 . . . . 0.0 109.333 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 46.7 t80 -70.5 -42.71 70.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.918 -1.114 . . . . 0.0 109.138 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.33 -34.12 36.93 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.31 -0.869 . . . . 0.0 109.492 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.21 -62.13 1.58 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.206 -0.934 . . . . 0.0 109.445 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.575 ' CD2' ' HG ' ' A' ' 35' ' ' LEU . 28.2 m-85 -56.6 -47.22 80.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.304 -0.873 . . . . 0.0 109.413 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 4.6 p -70.0 -17.56 63.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.478 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.484 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -91.26 15.31 61.47 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.465 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.1 mmt85 -89.61 -43.19 10.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.25 -1.147 . . . . 0.0 109.483 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 20' ' ' ARG . 7.0 mt-10 -164.9 119.73 1.35 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.252 -0.905 . . . . 0.0 109.47 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.545 ' HA3' ' HZ1' ' A' ' 26' ' ' LYS . . . 143.12 -117.3 1.09 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 22.4 m-20 -115.48 -2.99 12.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -1.161 . . . . 0.0 109.671 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 0.6 OUTLIER 76.25 17.7 2.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 109.502 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -142.04 10.82 1.97 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 109.482 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.545 ' HZ1' ' HA3' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -170.14 167.36 8.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.196 -0.94 . . . . 0.0 109.499 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.94 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.3 mp -100.31 164.78 11.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -0.932 . . . . 0.0 109.442 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 1.7 ptmm? -128.4 74.85 1.58 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.25 -0.906 . . . . 0.0 109.479 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 32' ' ' LEU . 11.4 ttmt 61.83 -85.57 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.395 -0.816 . . . . 0.0 110.206 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.47 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -44.8 -48.41 10.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.94 ' C ' HD23 ' A' ' 27' ' ' LEU . 78.5 mm-40 -56.02 -40.55 73.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 109.302 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.831 HD22 HD23 ' A' ' 60' ' ' LEU . 38.8 mt -60.06 -69.97 0.19 Allowed 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.633 -0.667 . . . . 0.0 109.571 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.471 ' HG2' ' OD1' ' A' ' 37' ' ' ASN . 14.2 ttmt -42.54 -27.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.318 -0.864 . . . . 0.0 109.729 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' N ' ' OE1' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -66.54 -54.32 25.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 109.469 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.879 HD21 HG13 ' A' ' 13' ' ' VAL . 16.1 mt -53.49 -37.49 62.78 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.676 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.084 HD11 ' CE2' ' A' ' 76' ' ' PHE . 3.1 mm -69.0 -38.7 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.553 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' OD1' ' HG2' ' A' ' 33' ' ' LYS . 7.2 m120 -82.88 -6.63 59.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 109.661 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.422 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -99.69 -18.24 17.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.514 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.703 ' OE1' HG13 ' A' ' 77' ' ' VAL . 19.6 tt0 -111.04 -57.57 2.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.229 -0.919 . . . . 0.0 109.544 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.674 ' H ' HD12 ' A' ' 40' ' ' LEU . 6.3 mp -65.5 -53.69 38.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.267 -0.896 . . . . 0.0 109.52 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.336 -0.853 . . . . 0.0 109.329 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.764 HD11 ' CG1' ' A' ' 80' ' ' VAL . 1.6 mt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER -40.78 -25.81 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.434 -0.791 . . . . 0.0 109.678 -179.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -95.64 41.7 1.1 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.211 179.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 10.0 mt-30 45.9 48.12 12.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.899 . . . . 0.0 109.515 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -90.14 -70.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.288 -0.883 . . . . 0.0 109.536 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.926 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.7 t -92.37 -15.58 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.199 -0.938 . . . . 0.0 109.168 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.676 HG23 HG23 ' A' ' 47' ' ' ILE . 42.5 t -81.71 -23.57 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 108.896 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 1.1 t0 -86.19 -30.26 22.56 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.32 -0.862 . . . . 0.0 109.085 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -82.65 -46.15 13.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 0.0 109.217 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.784 HG22 ' O ' ' A' ' 52' ' ' VAL . 35.3 m -58.37 -43.79 87.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.181 -0.949 . . . . 0.0 109.544 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.563 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.2 -28.47 3.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.086 -1.009 . . . . 0.0 109.99 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 59' ' ' THR . 1.2 pp20? -82.58 -34.64 27.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.043 -1.036 . . . . 0.0 109.719 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.524 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 16.9 m -78.31 -64.84 1.07 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.177 -0.952 . . . . 0.0 109.267 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.092 HD21 ' CG ' ' A' ' 76' ' ' PHE . 8.8 mp -39.41 -31.6 0.09 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.608 -0.682 . . . . 0.0 109.791 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' THR . 0.4 OUTLIER -43.96 105.84 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 61' ' ' ASP . 18.9 t-20 -44.93 -48.53 11.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -178.61 31.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.245 -0.91 . . . . 0.0 109.575 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.02 90.78 1.54 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -175.82 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.286 -1.126 . . . . 0.0 108.509 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.24 27.21 6.62 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.534 ' HB2' ' CG ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -138.13 119.07 14.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.256 -1.143 . . . . 0.0 109.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.0 t -69.89 158.61 35.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.215 -0.928 . . . . 0.0 109.782 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.543 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.75 172.12 7.58 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 1.5 t80 -60.16 -56.2 24.51 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.885 . . . . 0.0 110.585 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.842 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 1.6 mp0 -57.27 -31.18 65.34 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.886 . . . . 0.0 109.275 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.543 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 0.1 OUTLIER -79.18 -23.9 43.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.392 -0.817 . . . . 0.0 108.986 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.817 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.9 t80 -65.34 -58.04 6.9 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.416 -0.802 . . . . 0.0 108.952 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.24 -41.57 93.44 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.26 -0.9 . . . . 0.0 109.028 179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.44 -26.07 68.56 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.081 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 1.092 ' CG ' HD21 ' A' ' 60' ' ' LEU . 2.1 t80 -67.79 -63.59 1.03 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.352 -0.843 . . . . 0.0 109.31 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.703 HG13 ' OE1' ' A' ' 39' ' ' GLU . 25.3 t -58.9 -25.42 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.315 -0.866 . . . . 0.0 108.963 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.856 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.27 -33.4 74.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.43 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.6 OUTLIER -81.7 -68.11 0.72 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.926 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -49.08 -21.01 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 O-C-N 120.546 -1.346 . . . . 0.0 110.114 -178.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.578 HG23 ' N ' ' A' ' 82' ' ' THR . 5.8 t -87.61 -49.73 6.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.675 -1.265 . . . . 0.0 108.901 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.584 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.1 m -90.57 -56.39 3.22 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -33.73 -34.16 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.313 0.578 . . . . 0.0 109.913 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.51 ' N ' ' O ' ' A' ' 82' ' ' THR . 41.0 t -79.03 -50.17 11.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.227 -0.921 . . . . 0.0 109.529 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.0 OUTLIER -53.78 -56.74 14.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.263 -0.898 . . . . 0.0 109.512 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.94 -19.76 61.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.562 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.0 t80 . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -179.985 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.91 ' HG2' ' HB1' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -63.86 -72.2 0.15 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.587 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.91 HD21 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -62.33 -23.13 66.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.335 -0.853 . . . . 0.0 109.696 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.404 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 4.0 tt0 -62.56 -62.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.443 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -26.82 68.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.208 -0.933 . . . . 0.0 109.27 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -74.93 -23.6 58.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 109.429 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -37.75 36.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.266 -0.896 . . . . 0.0 109.466 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.46 ' O ' HG22 ' B' ' 11' ' ' ILE . 74.8 t -71.07 -35.61 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.26 -0.9 . . . . 0.0 109.642 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -78.21 -56.66 4.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.184 -0.948 . . . . 0.0 109.564 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.771 HD23 HD22 ' A' ' 3' ' ' LEU . 3.5 mt -54.29 -47.03 72.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 109.595 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.828 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -58.22 -46.89 88.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.137 -0.977 . . . . 0.0 109.425 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.571 ' N ' HG23 ' B' ' 11' ' ' ILE . 2.6 m-20 -58.91 -22.74 60.24 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.138 -0.976 . . . . 0.0 109.492 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.845 HG11 HD11 ' A' ' 3' ' ' LEU . 1.1 t -85.56 -29.98 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.504 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 49.3 t80 -66.5 -42.24 87.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.798 -1.189 . . . . 0.0 109.246 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -76.83 -41.32 44.7 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -0.917 . . . . 0.0 109.534 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.62 -65.91 0.62 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 0.0 109.516 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.587 ' CD1' HG13 ' B' ' 13' ' ' VAL . 33.0 m-85 -50.75 -41.7 56.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 109.379 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.53 ' HB3' ' N ' ' B' ' 26' ' ' LYS . 1.4 m -88.32 43.05 1.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.276 -0.89 . . . . 0.0 109.468 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.14 -61.05 0.67 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -50.96 -20.62 1.41 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.377 -1.072 . . . . 0.0 110.005 -179.604 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' B' ' 28' ' ' LYS . 4.5 tm-20 -69.68 155.14 40.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.087 -1.008 . . . . 0.0 109.421 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . -43.2 -91.79 0.01 OUTLIER Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.306 -1.518 . . . . 0.0 109.306 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.531 ' O ' ' N ' ' B' ' 25' ' ' HIS . 1.5 m-20 -68.31 86.99 0.29 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.223 -1.163 . . . . 0.0 108.948 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 18' ' ' SER . 8.6 pttp -41.97 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.451 -0.781 . . . . 0.0 109.829 -179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 23' ' ' ASP . 1.0 OUTLIER -170.46 -35.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.244 -0.91 . . . . 0.0 109.706 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -128.25 164.63 22.15 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.766 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.7 HD22 HD23 ' B' ' 32' ' ' LEU . 7.5 mp -90.56 164.55 14.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.34 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -131.32 74.35 1.59 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.325 -0.86 . . . . 0.0 109.346 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER 63.54 -83.21 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.607 -0.683 . . . . 0.0 110.363 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.465 ' O ' ' OE1' ' B' ' 34' ' ' GLU . 1.4 t -45.02 -44.55 10.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.147 -0.97 . . . . 0.0 110.591 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.678 ' C ' HD23 ' B' ' 27' ' ' LEU . 19.9 mm-40 -61.87 -39.32 91.5 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.76 -1.213 . . . . 0.0 108.718 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.7 HD23 HD22 ' B' ' 27' ' ' LEU . 28.9 mt -55.35 -70.31 0.11 Allowed 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 1.03 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -44.45 -28.12 0.53 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.885 . . . . 0.0 109.731 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -67.72 -68.36 0.39 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.126 -0.984 . . . . 0.0 109.558 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.915 HD21 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -41.72 -49.32 4.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.389 -0.819 . . . . 0.0 109.862 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.614 HD12 HG21 ' B' ' 80' ' ' VAL . 6.4 mm -56.0 -58.79 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.155 -0.965 . . . . 0.0 109.567 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.523 ' OD1' ' CG1' ' B' ' 47' ' ' ILE . 0.7 OUTLIER -85.06 15.19 4.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.0 109.844 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' B' ' 34' ' ' GLU . 5.2 m-20 -116.63 -8.97 11.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.473 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.527 ' HG2' ' CG ' ' A' ' 3' ' ' LEU . 12.5 mp0 -133.78 -44.38 0.81 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.614 HD13 ' CE ' ' A' ' 7' ' ' MET . 3.8 mm? -56.49 -62.7 1.55 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.212 -0.93 . . . . 0.0 109.202 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.699 . . . . 0.0 110.62 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.809 HG13 HG21 ' B' ' 53' ' ' VAL . 1.5 mm . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.485 ' CE ' ' OE2' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -43.38 -48.2 6.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.478 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -158.51 58.09 0.45 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.231 -0.918 . . . . 0.0 109.278 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.543 ' N ' HG22 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 62.35 36.23 14.58 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.257 -0.902 . . . . 0.0 109.294 -179.856 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' B' ' 48' ' ' LYS . 3.1 tt0 -65.18 -70.14 0.25 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.338 -0.851 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.924 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.5 t -88.57 -15.67 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.221 -0.925 . . . . 0.0 109.414 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.03 HG11 ' HG3' ' B' ' 33' ' ' LYS . 52.3 t -78.93 -30.38 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.087 -1.008 . . . . 0.0 108.927 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 21.0 t0 -82.82 -36.86 25.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.291 -0.881 . . . . 0.0 109.069 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -72.01 -47.43 51.98 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 0.0 109.208 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.861 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 33.9 m -59.84 -45.73 94.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 O-C-N 121.252 -0.905 . . . . 0.0 109.391 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.592 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.22 -24.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.878 -1.139 . . . . 0.0 109.977 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.8 tt0 -88.29 -45.86 9.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.11 -0.993 . . . . 0.0 110.377 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.758 HG21 ' SD ' ' B' ' 79' ' ' MET . 8.5 t -69.82 -52.91 21.0 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.913 -1.117 . . . . 0.0 110.003 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.751 HD21 ' CG ' ' B' ' 76' ' ' PHE . 5.6 mt -44.81 -65.27 0.55 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.986 -1.071 . . . . 0.0 109.093 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -45.55 102.61 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 109.496 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.54 11.06 7.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' HB2' ' B' ' 65' ' ' ASP . 3.4 p30 -111.39 -13.69 13.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 109.438 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.89 77.34 1.0 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.431 ' HB2' ' OD1' ' B' ' 63' ' ' ASP . 0.4 OUTLIER 178.14 -33.24 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.222 -1.163 . . . . 0.0 108.632 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.19 4.66 29.04 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.491 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 2.3 mm-40 -98.15 137.81 36.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -1.177 . . . . 0.0 109.446 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.5 t -79.33 159.21 27.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.169 -0.957 . . . . 0.0 109.639 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.503 ' CB ' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -125.69 171.51 10.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.378 -0.826 . . . . 0.0 108.82 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.8 OUTLIER -58.03 -53.31 59.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.224 -0.923 . . . . 0.0 110.27 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.642 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 8.5 mt-30 -58.16 -30.36 66.32 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.358 -0.839 . . . . 0.0 109.025 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.503 ' HG3' ' CB ' ' B' ' 69' ' ' ASP . 6.2 mt-10 -80.44 -22.02 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.433 -0.792 . . . . 0.0 109.278 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.478 ' HB2' ' CD1' ' B' ' 14' ' ' PHE . 2.8 t80 -69.26 -61.77 1.65 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.286 -0.884 . . . . 0.0 108.795 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.856 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -57.9 -42.51 84.85 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -61.85 -28.79 69.74 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.861 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.7 OUTLIER -64.31 -69.64 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.442 -0.786 . . . . 0.0 108.985 179.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' B' ' 81' ' ' THR . 43.1 t -51.93 -26.55 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.307 -0.87 . . . . 0.0 108.804 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -65.93 -42.97 89.4 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.37 -0.831 . . . . 0.0 109.432 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.758 ' SD ' HG21 ' B' ' 59' ' ' THR . 26.2 mtm -77.89 -69.56 0.54 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.266 -0.896 . . . . 0.0 109.568 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.924 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.69 -24.15 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 O-C-N 120.683 -1.261 . . . . 0.0 110.026 -178.795 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 23.0 m -82.52 -65.69 0.98 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.854 -1.154 . . . . 0.0 108.594 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.1 m -75.59 -54.58 6.77 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -34.89 -46.74 0.32 Allowed 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.213 0.53 . . . . 0.0 110.186 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 54.0 t -64.71 -49.74 69.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.213 -0.929 . . . . 0.0 109.585 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -16.88 35.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.892 . . . . 0.0 109.548 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -90.1 -27.02 19.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.926 . . . . 0.0 109.504 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.546 -179.988 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.773 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -69.71 -60.87 2.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.307 -0.871 . . . . 0.0 109.438 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.989 HD23 HG21 ' B' ' 77' ' ' VAL . 5.9 mp -66.32 -21.67 66.26 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.293 -0.88 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 25.9 mm-40 -63.99 -67.08 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.288 -0.882 . . . . 0.0 109.26 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.529 ' O ' HG12 ' A' ' 8' ' ' VAL . 10.1 mmtt -59.53 -44.89 93.07 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.212 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.656 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -62.86 -20.94 65.6 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.31 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.476 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 59.5 ttp -72.9 -53.03 12.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.314 -0.866 . . . . 0.0 109.334 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.529 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -64.15 -20.86 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.202 -0.937 . . . . 0.0 109.41 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.696 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -80.84 -69.99 0.56 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 109.748 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.515 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.3 OUTLIER -50.64 -48.54 58.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.65 -179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 1.2 mp -58.58 -50.23 79.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.158 -0.964 . . . . 0.0 109.101 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 45.0 t0 -60.53 -19.15 56.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.108 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.923 HG11 HD11 ' B' ' 3' ' ' LEU . 2.2 t -86.98 -26.17 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.078 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -70.45 -46.15 64.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.025 -1.047 . . . . 0.0 109.109 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -77.68 -34.22 53.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.393 -0.817 . . . . 0.0 109.625 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -69.22 -64.48 0.86 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.0 109.383 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.785 ' CG ' HD21 ' A' ' 35' ' ' LEU . 12.0 m-85 -51.25 -53.0 39.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 23' ' ' ASP . 1.4 t -63.7 -25.12 68.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.275 -0.891 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -54.92 -20.26 18.62 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -90.13 -29.44 18.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.256 -1.143 . . . . 0.0 109.658 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -83.35 69.94 10.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -0.931 . . . . 0.0 109.654 -179.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 47.02 96.7 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.4 OUTLIER 73.14 -149.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -1.177 . . . . 0.0 109.395 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.22 96.83 2.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.253 -0.905 . . . . 0.0 109.515 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.496 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 34.3 m-70 -145.63 -46.79 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 109.642 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 mttt -137.03 170.21 16.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 109.621 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 1.059 HD13 HD11 ' A' ' 35' ' ' LEU . 85.1 mt -115.5 131.33 56.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.191 -0.943 . . . . 0.0 109.558 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.813 ' O ' HD12 ' A' ' 32' ' ' LEU . 2.8 ptmt -76.78 164.03 26.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.206 -0.934 . . . . 0.0 108.768 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -27.18 0.14 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.92 . . . . 0.0 109.828 -179.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.464 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 3.5 m -77.45 -52.58 8.86 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 110.216 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.82 ' HB3' HD22 ' A' ' 27' ' ' LEU . 19.1 mm-40 -55.03 -39.1 68.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.307 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.061 HD13 ' CE ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -62.56 -70.17 0.22 Allowed 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.544 -0.723 . . . . 0.0 109.431 179.794 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.809 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -43.03 -26.61 0.15 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.165 -0.96 . . . . 0.0 109.586 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.492 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -71.4 -51.58 23.25 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.116 -0.99 . . . . 0.0 109.455 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.059 HD11 HD13 ' A' ' 27' ' ' LEU . 2.3 mt -60.15 -51.19 70.64 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.311 -0.868 . . . . 0.0 109.856 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.988 ' CD1' HG21 ' A' ' 80' ' ' VAL . 89.8 mt -62.08 -34.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 109.588 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.594 ' ND2' HD11 ' A' ' 47' ' ' ILE . 2.1 m-80 -92.46 -0.95 57.3 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.679 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 34' ' ' GLU . 0.8 OUTLIER -93.83 -43.44 8.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.54 ' CG ' ' HB2' ' B' ' 3' ' ' LEU . 54.5 mp0 -122.7 -10.06 8.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.31 -0.869 . . . . 0.0 109.4 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.526 ' CB ' ' O ' ' A' ' 36' ' ' ILE . 2.0 mp -108.6 -6.82 15.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HB3' ' HA ' ' A' ' 37' ' ' ASN . 1.9 p . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.199 -0.938 . . . . 0.0 109.478 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.685 ' N ' HD13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.484 ' HE2' ' HB2' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -43.51 -26.88 0.24 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 109.534 -179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 47' ' ' ILE . 1.3 tp10 176.79 55.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.535 ' HA ' HG21 ' A' ' 47' ' ' ILE . 13.1 mt-30 57.96 35.46 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.274 -0.891 . . . . 0.0 109.295 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -71.65 -70.15 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.239 -0.913 . . . . 0.0 109.756 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 1.012 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.3 t -83.42 -11.06 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.067 -1.02 . . . . 0.0 109.68 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.809 HG11 ' HD3' ' A' ' 33' ' ' LYS . 43.0 t -84.23 -37.43 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.828 -1.17 . . . . 0.0 108.32 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.2 t0 -90.2 -22.1 21.84 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 5.0 mttm -87.49 -48.42 7.96 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.488 -0.757 . . . . 0.0 109.207 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.869 HG22 HD21 ' A' ' 60' ' ' LEU . 1.2 p -64.19 -42.63 96.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 O-C-N 121.179 -0.951 . . . . 0.0 109.094 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 1.061 ' CE ' HD13 ' A' ' 32' ' ' LEU . 10.7 tpp -43.48 -45.49 6.45 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 5.4 tt0 -61.22 -44.17 97.7 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.236 -0.915 . . . . 0.0 108.827 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.0 m -62.55 -18.92 63.05 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.372 -0.83 . . . . 0.0 109.411 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.869 HD21 HG22 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -91.5 28.82 1.61 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.196 -0.94 . . . . 0.0 108.898 179.571 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 6.6 t0 -85.99 98.48 10.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.489 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.9 -23.33 14.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -140.22 9.71 2.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.261 -0.899 . . . . 0.0 109.47 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.425 ' HA2' ' OD1' ' A' ' 61' ' ' ASP . . . 69.03 83.62 0.16 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 178.8 -33.55 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.22 -1.164 . . . . 0.0 108.576 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 14.52 13.32 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 3.3 pt-20 -87.28 114.93 24.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.3 -1.118 . . . . 0.0 109.469 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.599 ' HB2' HD21 ' A' ' 32' ' ' LEU . 18.8 t -69.74 157.79 36.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -120.69 172.15 8.08 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.526 ' CZ ' HG13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.73 -55.96 16.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.085 -1.009 . . . . 0.0 110.129 -179.81 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.497 ' HG3' ' N ' ' A' ' 72' ' ' GLU . 8.4 pt20 -62.14 -39.4 92.46 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 tt0 -78.68 -10.43 59.75 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.574 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 34.2 t80 -73.73 -51.44 16.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.562 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -64.69 -46.99 80.02 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.03 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -68.32 -20.75 64.77 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.319 -0.863 . . . . 0.0 109.012 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.705 ' CE1' HD11 ' A' ' 36' ' ' ILE . 4.6 t80 -66.68 -70.39 0.25 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.192 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' B' ' 3' ' ' LEU . 81.5 t -60.18 -30.38 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.236 -0.915 . . . . 0.0 108.934 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.651 ' HB2' ' CG ' ' B' ' 74' ' ' MET . . . -60.29 -41.99 94.53 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.415 -0.803 . . . . 0.0 109.196 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.657 ' HE2' HG23 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -63.33 -50.74 68.81 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.163 -0.961 . . . . 0.0 108.701 179.503 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 1.012 ' HA ' HG11 ' A' ' 52' ' ' VAL . 1.5 t -65.33 -9.53 7.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.696 0 O-C-N 121.085 -1.009 . . . . 0.0 109.583 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.939 HG21 ' SD ' ' B' ' 7' ' ' MET . 52.7 m -86.85 -57.76 2.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.223 -0.923 . . . . 0.0 109.382 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -81.91 -48.81 11.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.162 -0.961 . . . . 0.0 109.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.584 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.42 -42.65 1.12 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.704 -0.622 . . . . 0.0 109.871 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.16 -51.3 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.903 . . . . 0.0 109.519 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -74.2 -9.98 59.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 109.497 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 83' ' ' ALA . 3.2 mt-10 -75.07 -34.86 61.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' A' ' 86' ' ' GLU . 4.3 t80 . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 109.593 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.534 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.696 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 3.6 mm-40 -76.13 -35.85 59.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 109.3 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.923 HD11 HG11 ' A' ' 13' ' ' VAL . 7.5 mp -78.99 -28.1 43.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.285 -0.885 . . . . 0.0 109.442 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.534 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 4.9 tm-20 -68.84 -58.84 3.6 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.899 . . . . 0.0 109.192 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.595 ' O ' HG12 ' B' ' 8' ' ' VAL . 19.4 mttt -62.61 -37.2 85.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.223 -0.923 . . . . 0.0 109.161 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.602 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -66.9 -19.52 65.74 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.38 -0.825 . . . . 0.0 109.308 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.939 ' SD ' HG21 ' A' ' 81' ' ' THR . 10.4 tpt -81.84 -38.47 25.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.342 -0.849 . . . . 0.0 109.368 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.595 HG12 ' O ' ' B' ' 5' ' ' LYS . 2.6 p -68.27 -30.89 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.286 -0.884 . . . . 0.0 109.413 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.773 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -82.47 -52.46 6.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 109.395 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.661 HD12 ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -53.29 -40.87 65.07 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.813 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -68.86 -46.37 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.376 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.58 ' N ' HG23 ' B' ' 11' ' ' ILE . 0.3 OUTLIER -51.89 -26.83 11.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 109.239 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 1.014 HG13 ' CD1' ' B' ' 17' ' ' TYR . 18.9 t -86.81 -30.87 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.26 -0.9 . . . . 0.0 109.366 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 2.7 t80 -59.48 -56.92 15.92 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.834 -1.166 . . . . 0.0 109.027 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.561 ' CE1' ' HB2' ' B' ' 24' ' ' LYS . 3.4 t60 -72.79 -48.41 38.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 109.636 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 44.9 tt0 -50.5 -68.39 0.18 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.841 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 1.014 ' CD1' HG13 ' B' ' 13' ' ' VAL . 25.4 m-85 -52.97 -32.77 47.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 110.072 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 86.3 p -87.36 31.57 0.73 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.044 -1.035 . . . . 0.0 109.942 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.02 -0.34 48.21 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.87 -58.27 2.63 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -1.17 . . . . 0.0 109.49 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.49 168.58 18.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.229 -0.92 . . . . 0.0 109.477 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.17 -105.88 3.17 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' B' ' 24' ' ' LYS . 0.2 OUTLIER -148.97 -68.67 0.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -1.143 . . . . 0.0 109.476 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.561 ' HB2' ' CE1' ' B' ' 15' ' ' HIS . 2.8 pttt 168.8 39.32 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.91 . . . . 0.0 109.503 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.574 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 3.9 p80 -169.74 27.53 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.713 ' O ' HD23 ' B' ' 27' ' ' LEU . 4.5 ptpt -153.97 167.66 29.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' B' ' 31' ' ' GLU . 78.9 mt -138.34 119.2 14.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.226 -0.921 . . . . 0.0 109.874 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.0 OUTLIER -85.77 118.86 25.53 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.279 -0.888 . . . . 0.0 108.666 179.114 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.535 ' N ' ' CE ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER 20.1 -78.76 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' B' ' 28' ' ' LYS . 69.3 p -40.73 -58.42 1.65 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.979 -1.075 . . . . 0.0 110.794 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.799 ' HB3' HD22 ' B' ' 27' ' ' LEU . 31.1 mm-40 -45.93 -43.84 14.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.903 -1.123 . . . . 0.0 109.166 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' B' ' 27' ' ' LEU . 20.2 mt -53.26 -66.07 0.45 Allowed 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.56 -0.713 . . . . 0.0 109.12 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.619 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -43.62 -36.27 2.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 109.646 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -54.97 -63.08 1.27 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 109.416 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.733 HD11 ' CG1' ' B' ' 13' ' ' VAL . 1.1 mp -50.71 -36.66 37.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.58 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.962 HD13 HG22 ' B' ' 53' ' ' VAL . 4.1 mt -61.43 -39.27 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.706 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.765 HD21 HD11 ' B' ' 47' ' ' ILE . 0.7 OUTLIER -96.38 -70.08 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 109.679 -179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -45.72 -24.34 0.35 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.289 -0.882 . . . . 0.0 109.963 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.883 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -113.91 -40.8 3.67 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.077 -1.015 . . . . 0.0 109.941 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.703 ' CD1' HG13 ' B' ' 77' ' ' VAL . 0.1 OUTLIER -109.52 67.98 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.132 -0.98 . . . . 0.0 109.601 -179.821 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 58.5 p . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.455 179.928 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.765 HD11 HD21 ' B' ' 37' ' ' ASN . 31.1 mm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.2 OUTLIER 84.4 -52.15 0.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.712 -0.618 . . . . 0.0 109.592 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.522 ' N ' ' CG ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -174.21 34.96 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.5 ' HA ' HG21 ' B' ' 47' ' ' ILE . 5.8 mt-30 73.73 38.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -65.47 -70.26 0.25 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.178 -0.951 . . . . 0.0 109.394 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.879 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.4 t -87.56 -15.41 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.142 -0.974 . . . . 0.0 109.152 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.962 HG22 HD13 ' B' ' 36' ' ' ILE . 39.5 t -75.17 -29.83 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.204 -0.935 . . . . 0.0 108.746 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 6.1 t0 -90.13 -36.92 14.56 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.425 -0.797 . . . . 0.0 109.314 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.471 ' HA ' ' OE2' ' B' ' 58' ' ' GLU . 23.7 mtpp -70.63 -36.17 73.32 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.316 -0.865 . . . . 0.0 109.534 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.964 ' HB ' HD13 ' B' ' 60' ' ' LEU . 5.3 m -55.44 -56.13 13.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.642 ' H ' HG23 ' B' ' 56' ' ' VAL . 0.2 OUTLIER -41.11 -28.32 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.93 -1.106 . . . . 0.0 109.625 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.471 ' OE2' ' HA ' ' B' ' 55' ' ' LYS . 45.0 mt-10 -70.06 -55.6 9.09 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' B' ' 60' ' ' LEU . 2.8 m -82.81 -63.06 1.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 1.053 HD21 ' CG ' ' B' ' 76' ' ' PHE . 1.7 mp -37.2 -36.5 0.14 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.761 -0.587 . . . . 0.0 109.898 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.524 ' CB ' ' O ' ' B' ' 57' ' ' MET . 11.1 t0 -90.11 70.03 7.29 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.398 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -100.09 8.88 43.61 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.9 -10.74 17.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.468 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 63.85 78.39 0.19 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 58.8 t0 178.99 -33.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.25 -1.147 . . . . 0.0 108.602 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 -9.37 31.52 Favored Glycine 0 N--CA 1.486 1.973 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.432 ' HB2' ' HD3' ' B' ' 26' ' ' LYS . 12.2 pt-20 -95.56 123.74 39.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -1.148 . . . . 0.0 109.474 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -69.63 133.42 47.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.273 -0.892 . . . . 0.0 109.338 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 23.0 t70 -98.05 170.76 8.7 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -55.74 -47.7 76.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.042 . . . . 0.0 110.061 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.444 ' HG2' ' SD ' ' A' ' 79' ' ' MET . 65.6 mt-30 -50.56 -49.31 56.41 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.546 -0.721 . . . . 0.0 109.319 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.546 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -72.17 -20.83 61.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.541 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.661 ' CE2' HD12 ' B' ' 10' ' ' LEU . 71.8 t80 -59.86 -57.78 11.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.651 ' CG ' ' HB2' ' A' ' 78' ' ' ALA . 3.4 mtt -66.61 -44.14 82.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.332 -0.855 . . . . 0.0 109.605 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -68.61 -12.21 61.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.081 -1.012 . . . . 0.0 109.21 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 1.053 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -81.52 -70.52 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.337 -0.852 . . . . 0.0 109.282 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.989 HG21 HD23 ' A' ' 3' ' ' LEU . 98.5 t -60.59 -30.25 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.88 . . . . 0.0 108.858 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.562 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -66.16 -45.57 80.49 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.459 -0.776 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.643 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 4.3 mmm -63.17 -70.34 0.22 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.059 -1.026 . . . . 0.0 108.914 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.879 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -41.81 -26.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 120.891 -1.131 . . . . 0.0 109.553 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.535 ' HA ' HD21 ' B' ' 40' ' ' LEU . 15.2 m -71.05 -70.23 0.32 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.053 -1.03 . . . . 0.0 108.885 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.0 OUTLIER -79.23 -50.77 10.41 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.113 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.4 -37.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.262 0.553 . . . . 0.0 109.848 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 8.6 t -84.88 -39.53 18.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 109.557 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -65.38 -9.98 29.49 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.605 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.492 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 0.5 OUTLIER -87.78 -21.55 25.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.241 -0.912 . . . . 0.0 109.525 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . 0.464 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.9 t80 . . . . . 0 N--CA 1.489 1.519 0 O-C-N 121.286 -0.884 . . . . 0.0 109.519 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.475 ' N ' ' HB2' ' A' ' 4' ' ' GLU . 1.1 t . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.753 ' HB2' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -47.65 -49.2 28.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.0 109.534 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.867 HD11 HG21 ' B' ' 13' ' ' VAL . 2.3 mp -76.49 -23.38 53.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.475 ' HB2' ' N ' ' A' ' 1' ' ' SER . 2.0 mt-10 -62.42 -63.91 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.346 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -38.59 90.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.311 -0.868 . . . . 0.0 109.297 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -70.63 -15.55 62.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.298 -0.876 . . . . 0.0 109.428 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.06 -46.49 16.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.316 -0.865 . . . . 0.0 109.385 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.11 -41.93 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.457 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HB1' ' OE1' ' B' ' 2' ' ' GLU . . . -67.7 -54.18 21.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.922 . . . . 0.0 109.42 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.532 ' HG ' ' CD1' ' B' ' 3' ' ' LEU . 0.2 OUTLIER -47.68 -46.37 29.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.2 -0.937 . . . . 0.0 109.397 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 45.5 mt -59.3 -38.95 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.396 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 91.3 m-20 -64.63 -24.46 67.59 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.262 -0.899 . . . . 0.0 109.532 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.918 HG21 HD21 ' B' ' 3' ' ' LEU . 2.7 t -81.01 -29.87 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 10.9 t80 -69.63 -47.77 62.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.941 -1.099 . . . . 0.0 109.507 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -78.99 -33.43 45.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.558 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 39.1 tt0 -68.82 -64.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.907 . . . . 0.0 109.468 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.69 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 26.0 m-85 -55.4 -48.23 74.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.5 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 33.7 t -69.64 -19.03 63.62 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.289 -0.882 . . . . 0.0 109.47 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.38 16.09 59.77 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 22.4 mmm180 -81.46 -46.65 14.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.492 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 1.0 OUTLIER -74.2 169.72 17.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.277 -0.889 . . . . 0.0 109.498 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.54 -52.87 7.28 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.0 -162.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -1.169 . . . . 0.0 109.421 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 179.5 80.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.297 -0.877 . . . . 0.0 109.449 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -152.82 -39.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.527 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -144.13 168.11 20.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.587 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.899 HD22 ' HB3' ' A' ' 31' ' ' GLU . 56.6 mt -86.17 152.08 23.12 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.339 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -119.16 69.45 0.82 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.777 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HD3' ' N ' ' A' ' 30' ' ' SER . 1.6 tmtt? 64.48 -81.6 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.518 -0.739 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.53 ' N ' ' HD3' ' A' ' 29' ' ' LYS . 4.3 m -48.28 -32.4 7.25 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.87 -1.144 . . . . 0.0 110.187 -179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.899 ' HB3' HD22 ' A' ' 27' ' ' LEU . 7.4 mm-40 -64.5 -43.01 95.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.962 -1.086 . . . . 0.0 108.568 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.651 HD22 HD13 ' A' ' 27' ' ' LEU . 3.2 mm? -55.93 -61.45 2.37 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.977 ' HG3' HG11 ' A' ' 53' ' ' VAL . 2.3 ttmt -52.15 -36.58 51.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.44 -0.788 . . . . 0.0 109.829 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -38.44 79.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 0.0 109.534 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.758 HD23 ' CE2' ' A' ' 76' ' ' PHE . 13.3 tp -75.14 -38.68 60.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.338 -0.851 . . . . 0.0 109.995 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.911 HG23 HD22 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -75.75 -14.16 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 109.744 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.474 ' HA ' ' OG ' ' A' ' 41' ' ' SER . 1.8 m-80 -93.82 -57.02 2.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.973 -1.08 . . . . 0.0 109.756 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -73.92 -10.94 60.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.236 -0.915 . . . . 0.0 109.723 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.802 ' C ' HD12 ' A' ' 40' ' ' LEU . 2.5 mm-40 -121.01 -33.31 3.76 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.065 -1.022 . . . . 0.0 109.968 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.911 HD22 HG23 ' A' ' 36' ' ' ILE . 7.4 mp -117.9 66.0 0.75 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.047 -1.033 . . . . 0.0 109.606 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.474 ' OG ' ' HA ' ' A' ' 37' ' ' ASN . 7.7 m . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.296 -0.878 . . . . 0.0 109.374 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 1.053 HD12 HG23 ' A' ' 53' ' ' VAL . 24.3 mm . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.336 0.588 . . . . 0.0 109.434 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.7 pttt 39.7 25.22 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.666 -0.646 . . . . 0.0 111.185 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 mt-10 161.13 34.07 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.998 -1.063 . . . . 0.0 110.244 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.747 ' N ' HG22 ' A' ' 47' ' ' ILE . 32.0 mt-30 40.33 37.11 0.39 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.278 -0.889 . . . . 0.0 109.748 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -68.45 -70.51 0.26 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.157 -0.964 . . . . 0.0 109.627 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 1.3 t -80.86 -9.78 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.058 -1.026 . . . . 0.0 109.158 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.053 HG23 HD12 ' A' ' 47' ' ' ILE . 55.9 t -80.83 -45.91 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.19 -0.944 . . . . 0.0 108.939 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.14 -28.3 60.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.457 -0.777 . . . . 0.0 108.959 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -56.33 4.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.39 -0.819 . . . . 0.0 109.257 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 1.1 HG11 HG22 ' A' ' 80' ' ' VAL . 17.1 m -57.08 -48.15 82.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.054 -1.029 . . . . 0.0 109.542 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.608 ' N ' HG23 ' A' ' 56' ' ' VAL . 19.1 tpp -42.89 -45.14 4.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.205 -0.934 . . . . 0.0 109.68 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.77 -49.25 73.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.18 -0.95 . . . . 0.0 109.489 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.583 HG21 ' SD ' ' A' ' 79' ' ' MET . 4.5 t -77.53 -8.97 58.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.288 -0.883 . . . . 0.0 109.913 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 32' ' ' LEU . 13.2 mt -97.27 11.58 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 109.397 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -77.97 113.88 16.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.245 -0.909 . . . . 0.0 109.511 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.524 ' ND2' ' HB2' ' A' ' 69' ' ' ASP . 13.6 t-20 -60.28 -50.37 73.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 109.477 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -150.35 16.5 0.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.176 -0.953 . . . . 0.0 109.589 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.08 75.18 1.29 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -176.98 30.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -1.163 . . . . 0.0 108.406 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 49.31 22.43 3.52 Favored Glycine 0 N--CA 1.482 1.758 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.3 mt-10 -106.76 96.57 6.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -1.141 . . . . 0.0 109.436 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.516 ' SG ' HD21 ' A' ' 32' ' ' LEU . 56.3 m -69.97 162.25 28.46 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.218 -0.926 . . . . 0.0 109.835 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.524 ' HB2' ' ND2' ' A' ' 62' ' ' ASN . 20.9 t70 -128.18 170.95 12.4 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -52.55 -51.22 60.74 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.093 -1.004 . . . . 0.0 110.203 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 0.5 OUTLIER -54.82 -30.6 57.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.28 -0.887 . . . . 0.0 109.103 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' CD2' ' A' ' 60' ' ' LEU . 3.8 mt-10 -82.52 -24.87 33.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' B' ' 3' ' ' LEU . 1.2 t80 -63.93 -57.55 9.44 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.121 -0.987 . . . . 0.0 108.642 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.909 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.1 OUTLIER -64.15 -48.88 74.33 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.343 -0.848 . . . . 0.0 108.763 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -55.52 -25.16 35.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.878 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -67.29 -69.41 0.31 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.438 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.878 HG23 ' CE2' ' A' ' 76' ' ' PHE . 40.0 t -53.45 -21.11 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.408 -0.807 . . . . 0.0 109.057 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.866 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.05 -50.29 64.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.332 -0.855 . . . . 0.0 109.484 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.657 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 44.8 mtp -73.6 -63.56 1.18 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.62 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 1.1 HG22 HG11 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -47.32 -22.83 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.842 0 O-C-N 120.565 -1.335 . . . . 0.0 109.41 -179.059 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.3 m -80.32 -68.83 0.64 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.03 -1.044 . . . . 0.0 109.123 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.8 t -74.32 -49.46 22.87 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.98 -1.075 . . . . 0.0 109.088 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.19 -31.08 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.421 0.629 . . . . 0.0 109.607 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.488 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.9 t -81.03 -58.36 3.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.0 109.288 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -45.05 -60.99 1.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.279 -0.888 . . . . 0.0 109.482 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -53.42 -47.53 69.53 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.39 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 58.8 t80 . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.516 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.661 ' HG3' HG23 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -70.96 -70.08 0.33 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.92 . . . . 0.0 109.485 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.918 HD21 HG21 ' A' ' 13' ' ' VAL . 3.3 mm? -75.12 -17.59 60.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.26 -0.9 . . . . 0.0 109.393 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' B' ' 7' ' ' MET . 22.5 tt0 -73.36 -61.72 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.418 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.612 ' O ' HG12 ' B' ' 8' ' ' VAL . 7.4 ttmt -61.0 -51.19 70.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -58.86 -15.76 14.09 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.505 ' SD ' ' CD1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -82.29 -53.86 5.7 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.612 HG12 ' O ' ' B' ' 5' ' ' LYS . 9.4 p -55.7 -28.55 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.241 -0.912 . . . . 0.0 109.545 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.753 ' HB1' ' HB2' ' A' ' 2' ' ' GLU . . . -78.47 -62.91 1.53 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.607 ' O ' HG12 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -50.71 -21.71 1.74 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.931 . . . . 0.0 109.557 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 73.8 mt -77.02 -62.43 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -48.17 -23.39 0.84 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.231 -0.918 . . . . 0.0 109.535 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.867 HG21 HD11 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -81.61 -40.38 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.513 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.561 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 28.1 t80 -57.05 -50.5 72.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.12 -0.987 . . . . 0.0 109.254 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.475 ' HA ' ' HB2' ' B' ' 18' ' ' SER . 14.7 m170 -67.85 -35.92 79.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.412 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -51.56 -57.45 9.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.484 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.935 ' CD2' HD21 ' B' ' 35' ' ' LEU . 78.8 m-85 -64.82 -28.05 69.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.225 -0.922 . . . . 0.0 109.482 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 0.6 OUTLIER -65.72 -20.94 66.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.925 . . . . 0.0 109.521 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.51 16.99 59.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 29.5 mmt180 -90.08 -57.48 2.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.256 -1.143 . . . . 0.0 109.432 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 165.73 23.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.297 -0.877 . . . . 0.0 109.409 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.11 -122.59 5.86 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' HB2' ' HE2' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -94.03 -156.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.292 -1.122 . . . . 0.0 109.517 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' B' ' 25' ' ' HIS . 13.0 mtmm -132.46 28.09 4.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 16.0 m170 -162.46 26.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.268 -0.895 . . . . 0.0 109.47 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.06 143.59 2.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.283 -0.885 . . . . 0.0 109.445 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.708 HD12 ' CB ' ' B' ' 31' ' ' GLU . 0.9 OUTLIER -93.24 167.27 11.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.957 . . . . 0.0 109.555 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.1 OUTLIER -135.7 80.58 1.84 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.388 -0.82 . . . . 0.0 109.369 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 64.0 -84.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.74 . . . . 0.0 110.32 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 29' ' ' LYS . 2.5 m -41.71 -57.51 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.136 -0.978 . . . . 0.0 110.482 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.708 ' CB ' HD12 ' B' ' 27' ' ' LEU . 64.7 mm-40 -61.15 -33.07 72.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.897 -1.127 . . . . 0.0 109.597 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.655 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 52.4 mt -56.0 -68.87 0.17 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.386 -0.821 . . . . 0.0 108.847 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.559 ' CD ' HG11 ' B' ' 53' ' ' VAL . 2.8 mttt -44.15 -33.88 1.66 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.32 -0.863 . . . . 0.0 109.073 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -58.73 -66.57 0.48 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.478 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.935 HD21 ' CD2' ' B' ' 17' ' ' TYR . 4.2 mm? -42.7 -40.65 2.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.88 . . . . 0.0 109.737 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.827 HD11 ' CZ ' ' B' ' 76' ' ' PHE . 2.8 mm -59.92 -50.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.227 -0.92 . . . . 0.0 109.687 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -81.14 6.29 14.25 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.235 -0.915 . . . . 0.0 109.612 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -127.44 7.03 6.35 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.184 -0.947 . . . . 0.0 109.714 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.869 ' CD ' HG22 ' B' ' 77' ' ' VAL . 5.8 pt-20 -142.87 -33.74 0.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.177 -0.952 . . . . 0.0 110.155 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.757 HD23 ' HA ' ' B' ' 36' ' ' ILE . 3.8 mm? -52.55 -69.07 0.12 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.016 -1.052 . . . . 0.0 109.403 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.9 p . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.397 -0.815 . . . . 0.0 109.389 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.727 HG21 ' HA ' ' B' ' 50' ' ' GLN . 14.5 mm . . . . . 0 N--CA 1.497 1.894 0 CA-C-O 120.694 0.283 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 84.58 -36.28 0.06 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.392 -0.818 . . . . 0.0 109.82 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.539 ' N ' ' HG2' ' B' ' 48' ' ' LYS . 5.0 tt0 178.46 33.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.076 -1.015 . . . . 0.0 109.48 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.727 ' HA ' HG21 ' B' ' 47' ' ' ILE . 0.9 OUTLIER 50.14 51.32 16.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.13 -57.28 2.91 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.635 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.838 HG11 ' HA ' ' B' ' 80' ' ' VAL . 40.1 t -86.97 -13.58 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.655 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.679 HG21 HG13 ' B' ' 47' ' ' ILE . 37.7 t -77.47 -15.62 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 120.902 -1.124 . . . . 0.0 109.339 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -48.84 6.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.327 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -72.31 -42.04 65.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.874 . . . . 0.0 109.383 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.978 HG21 ' CE1' ' B' ' 76' ' ' PHE . 5.4 p -56.4 -46.48 81.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.203 -0.936 . . . . 0.0 109.386 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.655 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 8.1 tpp -42.79 -47.1 5.43 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.416 -0.802 . . . . 0.0 109.169 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.447 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.9 OUTLIER -57.14 -45.11 83.81 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.749 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.712 HG22 ' O ' ' B' ' 56' ' ' VAL . 3.9 t -75.14 -12.24 60.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.0 110.077 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.605 HD21 ' CG ' ' B' ' 76' ' ' PHE . 34.1 mt -91.12 -9.03 47.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.34 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 17.1 p-10 -62.6 113.39 2.96 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.276 -0.89 . . . . 0.0 109.576 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.516 ' CA ' ' OE2' ' B' ' 72' ' ' GLU . 9.1 p-10 -81.17 -45.89 15.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.266 -0.896 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.43 ' N ' ' CG ' ' B' ' 62' ' ' ASN . 0.6 OUTLIER -131.77 1.0 3.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 75.51 1.2 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -175.3 29.83 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -1.156 . . . . 0.0 108.385 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.3 26.26 6.6 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.454 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 87.0 mt-10 -105.76 111.95 24.83 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -1.136 . . . . 0.0 109.437 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 16.2 t -69.64 159.02 34.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.493 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.3 OUTLIER -130.03 172.54 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.424 -0.797 . . . . 0.0 109.249 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.467 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.2 OUTLIER -58.33 -53.56 56.88 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.377 -0.827 . . . . 0.0 110.466 -179.667 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.714 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.87 -40.55 89.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.28 -0.887 . . . . 0.0 108.611 -179.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.516 ' OE2' ' CA ' ' B' ' 62' ' ' ASN . 0.3 OUTLIER -76.48 -12.07 59.98 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.442 -0.786 . . . . 0.0 109.083 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.561 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 8.5 t80 -73.26 -57.99 3.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.866 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.51 -45.72 90.91 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.102 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -60.02 -33.18 71.65 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.353 -0.842 . . . . 0.0 108.784 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.978 ' CE1' HG21 ' B' ' 56' ' ' VAL . 1.0 OUTLIER -57.26 -70.03 0.14 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.014 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.869 HG22 ' CD ' ' B' ' 39' ' ' GLU . 6.7 t -50.22 -32.34 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.468 -0.77 . . . . 0.0 109.31 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.909 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -58.98 -45.55 90.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 109.867 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.695 ' HE3' HG21 ' B' ' 59' ' ' THR . 2.7 mpp? -76.46 -68.4 0.6 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.197 -0.94 . . . . 0.0 109.825 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.838 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.29 -24.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.452 -1.405 . . . . 0.0 109.441 -179.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.504 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 8.5 m -77.7 -68.1 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.051 -1.031 . . . . 0.0 108.916 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -79.08 -49.65 12.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 108.798 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.69 -37.43 0.22 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.742 -0.599 . . . . 0.0 109.789 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 43.3 t -72.96 -48.31 37.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.3 -0.875 . . . . 0.0 109.47 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.66 -10.06 32.86 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.243 -0.911 . . . . 0.0 109.473 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -38.52 69.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 0.0 109.411 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 t80 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.305 -0.872 . . . . 0.0 109.442 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 29.6 t . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.371 0.605 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.32 -70.67 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 109.913 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.92 HD22 ' OE2' ' B' ' 39' ' ' GLU . 6.0 mt -78.51 -33.13 48.3 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.118 -0.989 . . . . 0.0 110.02 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 11.5 tt0 -57.77 -59.97 4.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.086 -1.008 . . . . 0.0 109.246 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.17 -53.21 59.86 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.347 -0.845 . . . . 0.0 109.469 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -61.24 -12.84 14.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.295 -0.878 . . . . 0.0 109.671 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.781 ' O ' HD12 ' A' ' 11' ' ' ILE . 4.9 ttp -80.29 -60.43 2.33 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.172 -0.955 . . . . 0.0 109.435 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 8' ' ' VAL . 4.2 t -55.01 -27.89 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.482 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -77.82 -64.31 1.18 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.63 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.52 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.2 OUTLIER -43.3 -53.4 5.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 0.0 109.754 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.781 HD12 ' O ' ' A' ' 7' ' ' MET . 2.1 mp -59.24 -45.88 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.275 -0.891 . . . . 0.0 109.583 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 0.5 OUTLIER -55.74 -23.48 29.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.195 -0.941 . . . . 0.0 109.413 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.868 ' CG1' HD21 ' A' ' 35' ' ' LEU . 1.2 t -89.13 -27.09 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.259 -0.901 . . . . 0.0 109.231 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.583 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 10.3 t80 -64.67 -42.4 95.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.012 -1.055 . . . . 0.0 109.057 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.568 ' CE1' ' CE1' ' A' ' 25' ' ' HIS . 3.8 m-70 -82.4 -44.37 16.18 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.325 -0.859 . . . . 0.0 109.518 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -52.8 -59.44 4.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.512 ' CD1' HG13 ' A' ' 13' ' ' VAL . 34.6 m-85 -61.85 -45.76 92.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.891 . . . . 0.0 109.616 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.758 ' OG ' HD12 ' A' ' 27' ' ' LEU . 48.2 m -72.26 -3.08 21.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.772 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 15' ' ' HIS . . . -75.1 -9.16 83.95 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HD3' ' OE2' ' A' ' 31' ' ' GLU . 16.9 mtt85 -87.93 -34.68 18.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.305 -1.115 . . . . 0.0 109.462 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 8.9 tt0 -69.94 154.4 42.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.299 -0.876 . . . . 0.0 109.381 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -43.49 -26.94 0.73 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' OD2' ' HD3' ' A' ' 26' ' ' LYS . 37.1 t70 -112.34 135.62 52.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 18' ' ' SER . 6.4 ptmt -91.99 70.91 5.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.287 -0.883 . . . . 0.0 109.571 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.576 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -170.2 -34.79 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -118.75 151.05 38.74 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.975 . . . . 0.0 109.785 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.863 HD22 HD23 ' A' ' 32' ' ' LEU . 7.2 mp -89.77 165.92 13.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.232 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 10.4 pttp -122.47 69.94 0.98 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.203 -0.935 . . . . 0.0 109.634 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' A' ' 30' ' ' SER . 0.3 OUTLIER 62.18 -84.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.453 -0.779 . . . . 0.0 110.339 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.496 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 7.9 t -46.1 -42.22 13.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.169 -0.957 . . . . 0.0 110.445 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.789 ' C ' HD23 ' A' ' 27' ' ' LEU . 67.5 mm-40 -56.77 -42.46 79.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.906 -1.121 . . . . 0.0 109.146 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.94 HD13 HD12 ' A' ' 60' ' ' LEU . 33.1 mt -60.15 -65.53 0.67 Allowed 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.528 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 2.4 ttpp -40.8 -29.61 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.369 -0.832 . . . . 0.0 109.52 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -66.81 -58.1 5.72 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.322 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.868 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.8 -29.08 17.66 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.36 -0.837 . . . . 0.0 109.569 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.738 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.0 mp -74.46 -40.02 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.148 -0.97 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.528 ' ND2' ' HG3' ' A' ' 33' ' ' LYS . 73.2 m-80 -90.19 6.1 44.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 109.689 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.71 -37.58 5.63 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 109.414 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.521 ' OE1' HD22 ' B' ' 3' ' ' LEU . 1.9 pt-20 -111.76 -25.82 9.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.315 -0.866 . . . . 0.0 109.327 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.52 ' CD1' ' HB ' ' A' ' 80' ' ' VAL . 89.2 mt -108.28 69.44 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.904 HD12 HG21 ' A' ' 53' ' ' VAL . 5.5 mm . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 85.53 -32.15 0.05 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.814 -0.554 . . . . 0.0 109.767 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 3.2 mt-10 162.52 64.7 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.193 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.2 OUTLIER 33.45 48.35 0.18 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.247 0.546 . . . . 0.0 110.045 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.407 ' OE1' ' C ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -90.05 -62.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.347 -0.846 . . . . 0.0 109.772 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.933 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.6 t -88.35 -14.33 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.072 -1.017 . . . . 0.0 109.92 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.904 HG21 HD12 ' A' ' 47' ' ' ILE . 27.4 t -84.01 -28.43 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.832 -1.167 . . . . 0.0 108.68 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.69 -33.23 20.11 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.27 -0.894 . . . . 0.0 108.773 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -51.43 7.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.82 . . . . 0.0 108.974 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.905 HG22 HD21 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -60.62 -41.87 89.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 O-C-N 121.159 -0.963 . . . . 0.0 108.896 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.77 ' SD ' HD12 ' A' ' 32' ' ' LEU . 7.1 tpt -42.01 -50.02 4.64 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.595 -0.69 . . . . 0.0 109.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -43.85 88.28 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.233 -0.917 . . . . 0.0 108.942 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.526 HG21 ' SD ' ' A' ' 79' ' ' MET . 15.8 m -62.23 -23.8 66.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.359 -0.838 . . . . 0.0 109.652 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.94 HD12 HD13 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -85.66 -27.43 25.38 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.13 -0.981 . . . . 0.0 109.275 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.613 ' OD1' ' HE2' ' A' ' 57' ' ' MET . 82.2 m-20 -63.41 114.08 3.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.224 -0.922 . . . . 0.0 109.51 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.4 ' HA ' ' OE2' ' A' ' 72' ' ' GLU . 5.5 t-20 -47.95 -43.08 28.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 109.425 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.99 25.82 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.441 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.16 88.84 2.04 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.11 -34.43 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.2 -1.177 . . . . 0.0 108.622 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 27' ' ' LEU . . . 110.1 -19.02 27.96 Favored Glycine 0 N--CA 1.485 1.947 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.415 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 26.8 mt-10 -73.11 97.4 2.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 109.541 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 12.9 t -69.79 154.28 42.18 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.198 -0.939 . . . . 0.0 109.619 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.482 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -113.32 171.33 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.806 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.522 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.1 OUTLIER -61.39 -50.13 74.11 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.229 -0.919 . . . . 0.0 110.091 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.548 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 4.4 mp0 -54.83 -40.05 69.2 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.316 -0.865 . . . . 0.0 109.145 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 60' ' ' LEU . 2.4 mt-10 -79.69 -17.82 52.74 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.306 -0.871 . . . . 0.0 109.663 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.743 ' CZ ' HD21 ' B' ' 3' ' ' LEU . 22.1 t80 -69.56 -54.72 12.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.07 -1.019 . . . . 0.0 108.84 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.693 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 1.6 ttm -64.42 -44.4 91.35 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.278 -0.889 . . . . 0.0 108.787 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' ' CE ' ' A' ' 79' ' ' MET . . . -64.04 -25.11 67.97 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.303 -0.873 . . . . 0.0 108.817 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.09 -65.72 0.64 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 HD23 ' B' ' 3' ' ' LEU . 39.9 t -61.31 -22.14 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.885 . . . . 0.0 108.95 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.797 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.42 -40.97 89.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.365 -0.834 . . . . 0.0 109.341 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.651 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 49.3 mtm -78.02 -66.26 0.87 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.281 -0.887 . . . . 0.0 109.42 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.933 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.48 -22.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 O-C-N 120.474 -1.391 . . . . 0.0 109.462 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.495 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 6.2 m -80.67 -68.0 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.002 -1.061 . . . . 0.0 109.096 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.557 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.4 t -75.94 -49.33 18.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.0 109.089 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.52 -40.89 0.27 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.707 -0.621 . . . . 0.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.4 t -77.4 -42.57 35.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -0.906 . . . . 0.0 109.523 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 82' ' ' THR . 21.8 t-160 -64.44 -11.0 28.85 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.219 -0.926 . . . . 0.0 109.522 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -39.04 21.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.286 -0.884 . . . . 0.0 109.504 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.0 t80 . . . . . 0 N--CA 1.49 1.53 0 O-C-N 121.256 -0.903 . . . . 0.0 109.502 -179.985 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.526 ' HB2' HG21 ' A' ' 13' ' ' VAL . 2.1 mp0 -72.74 -69.26 0.42 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.423 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.971 HD23 HG21 ' A' ' 77' ' ' VAL . 6.2 mp -65.39 -11.16 39.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.905 . . . . 0.0 109.468 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.987 ' O ' HG23 ' B' ' 8' ' ' VAL . 30.9 tt0 -73.83 -62.58 1.45 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.219 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.47 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -65.39 -36.55 84.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.268 -0.895 . . . . 0.0 109.135 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.27 -66.46 0.54 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.308 -0.87 . . . . 0.0 109.433 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.483 ' O ' HG12 ' B' ' 11' ' ' ILE . 0.4 OUTLIER -45.3 -30.81 1.36 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.309 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.987 HG23 ' O ' ' B' ' 4' ' ' GLU . 79.6 t -60.64 -55.61 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.122 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -44.92 87.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.177 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.741 ' CD1' HD23 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -58.76 -26.44 64.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.312 -0.868 . . . . 0.0 109.34 179.824 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.927 HD13 ' CZ ' ' B' ' 70' ' ' PHE . 9.0 mm -70.08 -48.29 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.267 -0.895 . . . . 0.0 109.108 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.8 OUTLIER -65.43 -19.03 65.77 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.49 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.559 HG11 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -88.22 -30.85 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.227 -0.92 . . . . 0.0 109.338 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 18.8 t80 -67.91 -46.07 72.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.02 -1.05 . . . . 0.0 109.214 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 53.6 m170 -79.53 -34.24 41.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.242 -0.911 . . . . 0.0 109.64 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -62.7 -61.75 2.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 109.455 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.961 ' CG ' HD21 ' B' ' 35' ' ' LEU . 35.9 m-85 -58.19 -44.58 88.14 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.233 -0.917 . . . . 0.0 109.614 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.473 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 83.4 p -67.0 -18.88 65.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.565 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.85 13.73 66.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.529 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.07 -38.24 13.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -1.158 . . . . 0.0 109.435 179.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -166.05 140.36 4.46 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 109.468 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 23' ' ' ASP . . . 84.28 -149.39 24.95 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.452 ' O ' ' O ' ' B' ' 18' ' ' SER . 4.0 p30 -54.75 -169.55 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.8 ptpt -134.12 11.85 3.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.407 ' C ' ' HD3' ' B' ' 26' ' ' LYS . 25.4 m-70 -138.27 7.15 2.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 109.595 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -143.07 170.14 16.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.701 HD23 ' C ' ' B' ' 31' ' ' GLU . 4.2 mp -121.96 139.26 53.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.165 -0.959 . . . . 0.0 110.3 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.523 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 14.7 tttm -86.18 156.95 20.11 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' B' ' 32' ' ' LEU . 11.8 mttt -37.46 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.062 -1.023 . . . . 0.0 109.987 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.521 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.5 OUTLIER -79.0 -45.95 19.19 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.701 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.2 OUTLIER -58.47 -40.26 82.22 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 120.808 -1.182 . . . . 0.0 108.776 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.919 HD21 ' SG ' ' B' ' 68' ' ' CYS . 2.6 mt -59.12 -63.4 1.32 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.746 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -39.97 -44.21 1.67 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.514 -0.741 . . . . 0.0 109.871 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.46 -61.04 2.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.961 HD21 ' CG ' ' B' ' 17' ' ' TYR . 2.4 mm? -49.29 -58.56 4.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -0.864 . . . . 0.0 109.804 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.982 HD12 HG22 ' B' ' 53' ' ' VAL . 0.7 OUTLIER -43.23 -35.34 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.31 -0.869 . . . . 0.0 109.739 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -73.67 -54.8 7.28 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 110.142 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' B' ' 38' ' ' ASN . 1.5 m120 -96.29 27.59 3.66 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.171 -0.956 . . . . 0.0 109.579 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.92 ' OE2' HD22 ' A' ' 3' ' ' LEU . 21.5 tt0 -127.79 -37.79 1.92 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.236 -0.915 . . . . 0.0 109.321 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.3 mm? -73.02 -56.26 5.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.313 -0.867 . . . . 0.0 109.285 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 5.4 t . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.499 -0.75 . . . . 0.0 108.978 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.805 HD12 HG23 ' B' ' 53' ' ' VAL . 23.3 mm . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.26 0.552 . . . . 0.0 109.561 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.481 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 42.98 26.2 0.07 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.08 -1.012 . . . . 0.0 109.577 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.481 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.4 tt0 75.02 87.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.115 -0.991 . . . . 0.0 109.83 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.478 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 42.39 50.66 4.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.322 -0.861 . . . . 0.0 109.839 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.491 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.5 tp10 -91.2 -70.57 0.68 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.174 -0.954 . . . . 0.0 109.705 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 1.023 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.0 t -91.51 -15.04 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.182 -0.949 . . . . 0.0 109.38 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.982 HG22 HD12 ' B' ' 36' ' ' ILE . 62.3 t -84.28 -30.01 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 120.966 -1.084 . . . . 0.0 108.594 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 10.1 t0 -90.18 -29.08 18.47 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.308 -0.87 . . . . 0.0 108.873 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 10.5 mtmt -85.27 -47.93 9.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.392 -0.817 . . . . 0.0 109.23 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.918 HG22 HD21 ' B' ' 60' ' ' LEU . 0.6 OUTLIER -65.66 -40.67 88.61 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.124 -0.985 . . . . 0.0 109.006 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.84 ' SD ' HD13 ' B' ' 32' ' ' LEU . 8.0 tpt -39.9 -52.53 2.39 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.763 -0.586 . . . . 0.0 109.723 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.73 -42.27 96.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.196 -0.94 . . . . 0.0 108.863 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.409 ' N ' ' O ' ' B' ' 56' ' ' VAL . 96.6 m -62.22 -20.51 64.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.363 -0.836 . . . . 0.0 109.799 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.918 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -85.33 -73.62 0.43 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.041 -1.037 . . . . 0.0 109.189 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.46 ' HA ' ' OE1' ' B' ' 72' ' ' GLU . 9.8 t70 -84.64 93.12 8.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.28 -0.888 . . . . 0.0 109.547 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.29 10.74 40.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.907 . . . . 0.0 109.369 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -92.43 -41.84 10.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 109.558 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 90.05 2.1 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -172.87 -37.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.293 -1.122 . . . . 0.0 108.463 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 32.88 3.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 5.2 mt-10 -144.9 113.11 6.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.255 -1.144 . . . . 0.0 109.361 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.919 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.86 151.18 46.0 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.202 -0.936 . . . . 0.0 109.904 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.497 ' HB3' ' HG3' ' B' ' 72' ' ' GLU . 4.5 t70 -112.46 171.29 7.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -0.856 . . . . 0.0 108.724 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.927 ' CZ ' HD13 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -54.36 -53.0 59.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.225 -0.922 . . . . 0.0 110.491 -179.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.425 ' OE1' ' OD2' ' B' ' 69' ' ' ASP . 0.0 OUTLIER -56.61 -26.65 56.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.151 -0.968 . . . . 0.0 109.269 -179.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' B' ' 69' ' ' ASP . 6.5 mt-10 -85.58 -22.66 27.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 109.831 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.539 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 50.8 t80 -74.28 -40.41 62.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.09 -1.006 . . . . 0.0 108.943 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.797 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -75.6 -41.12 55.33 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.48 -0.762 . . . . 0.0 109.196 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.452 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -65.21 -30.95 71.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.15 -0.969 . . . . 0.0 108.861 179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.691 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -66.08 -63.37 1.1 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.449 -0.782 . . . . 0.0 108.944 179.691 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.564 ' N ' ' CG ' ' B' ' 76' ' ' PHE . 52.2 t -57.83 -26.78 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.189 -0.944 . . . . 0.0 109.351 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.693 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.09 -34.49 77.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.345 -0.847 . . . . 0.0 109.472 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.652 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.3 OUTLIER -82.86 -69.4 0.63 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 109.659 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 1.023 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.88 -23.78 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.549 -1.345 . . . . 0.0 109.334 -179.413 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 12.0 m -78.42 -67.74 0.71 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.561 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -78.22 -49.54 13.57 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.136 -0.977 . . . . 0.0 108.874 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.652 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.83 -36.38 0.11 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.769 -0.582 . . . . 0.0 109.82 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.3 t -90.03 -36.94 14.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.202 -0.936 . . . . 0.0 109.438 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' B' ' 82' ' ' THR . 60.3 t60 -62.33 -12.95 23.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.95 -31.3 23.66 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.2 -0.938 . . . . 0.0 109.406 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.437 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 16.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.518 ' HG2' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -74.31 -77.54 0.11 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.457 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.713 HD13 ' HG2' ' B' ' 39' ' ' GLU . 7.3 mp -66.91 -15.53 63.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.447 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.783 ' O ' HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -73.65 -63.02 1.29 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.378 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.449 ' O ' ' HD2' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -63.08 -34.18 77.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.249 -0.907 . . . . 0.0 109.356 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.518 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -66.44 -66.92 0.49 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 0.0 109.549 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.618 ' O ' HD12 ' A' ' 11' ' ' ILE . 6.8 ptm -43.93 -31.78 0.96 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 4' ' ' GLU . 71.5 t -62.4 -55.65 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.513 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.862 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -63.42 -57.72 9.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.504 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.148 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -44.04 -37.96 3.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 109.372 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.618 HD12 ' O ' ' A' ' 7' ' ' MET . 32.9 mt -64.64 -45.8 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.937 . . . . 0.0 109.36 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -58.27 -23.68 56.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.282 -0.886 . . . . 0.0 109.302 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -83.47 -38.6 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.264 -0.898 . . . . 0.0 109.398 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.0 t80 -59.56 -51.96 67.58 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 120.92 -1.112 . . . . 0.0 109.425 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -55.16 14.88 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.562 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -46.09 -69.47 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.221 -0.924 . . . . 0.0 109.605 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.58 ' CE1' ' HG ' ' A' ' 35' ' ' LEU . 41.3 m-85 -50.2 -27.67 6.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.248 -0.908 . . . . 0.0 109.561 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.484 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -62.52 -44.9 95.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 109.427 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -55.27 -18.52 14.05 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 27.8 mmm180 -68.14 -41.87 81.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.308 -1.113 . . . . 0.0 109.419 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.568 ' CG ' ' CD ' ' A' ' 28' ' ' LYS . 2.7 tm-20 -82.23 161.24 22.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.318 -0.864 . . . . 0.0 109.433 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -45.52 -51.04 10.11 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -94.97 167.33 11.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.232 -1.158 . . . . 0.0 109.402 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.526 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 11.4 mttt -118.13 86.96 2.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.294 -0.879 . . . . 0.0 109.522 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.9 t-80 -170.08 -35.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.911 . . . . 0.0 109.624 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 5.7 mtmt -140.05 170.11 16.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 ' HB3' ' A' ' 31' ' ' GLU . 82.5 mt -107.05 170.09 8.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.284 -0.885 . . . . 0.0 109.497 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.568 ' CD ' ' CG ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -128.97 73.59 1.52 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.141 -0.974 . . . . 0.0 109.917 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.853 ' HA ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttmt 62.35 -84.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.442 -0.786 . . . . 0.0 110.696 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.467 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.8 OUTLIER -43.81 -50.53 7.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.115 -0.991 . . . . 0.0 110.567 -179.058 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.772 ' HB3' HD22 ' A' ' 27' ' ' LEU . 6.1 mm-40 -52.69 -40.89 63.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.972 -1.08 . . . . 0.0 109.513 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 29' ' ' LYS . 14.2 mt -58.92 -65.89 0.59 Allowed 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.623 -0.673 . . . . 0.0 109.631 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.52 ' CA ' HG13 ' A' ' 36' ' ' ILE . 7.1 ttpp -38.47 -37.64 0.32 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.578 -0.701 . . . . 0.0 110.016 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.448 ' O ' ' OD1' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -65.9 -50.29 65.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -0.939 . . . . 0.0 109.474 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 13' ' ' VAL . 1.3 mt -60.93 -21.53 63.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 0.0 109.783 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.909 ' CD1' HG13 ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.25 -57.97 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.166 -0.959 . . . . 0.0 109.575 -179.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.424 ' OD1' HD12 ' A' ' 47' ' ' ILE . 70.3 m-80 -70.1 -5.18 25.1 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.19 -0.944 . . . . 0.0 109.67 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 34' ' ' GLU . 6.5 m120 -114.39 -8.75 12.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.186 -0.946 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.768 ' OE2' HG13 ' A' ' 77' ' ' VAL . 1.8 tm-20 -94.25 -46.91 6.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.175 -0.953 . . . . 0.0 109.584 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.669 HD22 ' N ' ' A' ' 40' ' ' LEU . 2.9 mm? -72.9 -52.35 15.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.215 -0.928 . . . . 0.0 109.555 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.428 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.155 -0.965 . . . . 0.0 109.656 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.6 ' CG2' ' CG2' ' A' ' 53' ' ' VAL . 6.1 mt . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -42.5 -34.79 0.9 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.355 -0.841 . . . . 0.0 109.444 179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' A' ' 50' ' ' GLN . 14.1 pt-20 178.37 -31.72 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.449 -0.782 . . . . 0.0 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 1.2 pt20 -159.72 29.98 0.19 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.266 -0.896 . . . . 0.0 109.759 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.79 -70.86 0.16 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.033 -1.042 . . . . 0.0 108.802 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.836 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -90.96 -12.72 9.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.909 HG13 ' CD1' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -76.91 -30.27 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 22.6 t70 -76.24 -47.18 24.85 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.278 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -50.54 63.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.296 -0.878 . . . . 0.0 109.394 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 1.013 HG11 HG22 ' A' ' 80' ' ' VAL . 24.0 m -57.78 -47.31 86.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.114 -0.991 . . . . 0.0 109.58 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.602 ' N ' HG23 ' A' ' 56' ' ' VAL . 9.9 tpt -38.21 -49.55 1.37 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.576 -0.702 . . . . 0.0 110.349 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -60.02 -46.1 90.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.12 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 59' ' ' THR . 28.6 m -73.18 -8.76 57.21 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.443 -0.786 . . . . 0.0 109.856 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.656 ' N ' HD23 ' A' ' 60' ' ' LEU . 1.9 mt -84.78 -27.68 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.166 -0.959 . . . . 0.0 109.324 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -43.73 110.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.537 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.521 ' CB ' ' OD1' ' A' ' 69' ' ' ASP . 33.2 t30 -60.1 -52.05 67.0 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.3 -0.875 . . . . 0.0 109.42 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -152.57 18.12 0.62 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.224 -0.922 . . . . 0.0 109.519 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.79 88.53 1.77 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.28 -36.66 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.301 -1.117 . . . . 0.0 108.525 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.2 -1.23 31.26 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -99.83 121.7 41.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.213 -1.169 . . . . 0.0 109.483 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.647 ' CB ' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -69.51 131.28 44.47 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.521 ' OD1' ' CB ' ' A' ' 62' ' ' ASN . 2.2 m-20 -110.27 170.66 7.93 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.579 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 1.2 t80 -52.96 -50.63 63.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.071 -1.018 . . . . 0.0 110.406 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.482 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 10.2 mt-30 -51.92 -46.48 64.66 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.501 -0.749 . . . . 0.0 109.752 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' HA ' ' A' ' 68' ' ' CYS . 0.5 OUTLIER -74.38 -18.6 60.65 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.095 -1.003 . . . . 0.0 109.695 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 1.148 ' CE2' HD23 ' A' ' 10' ' ' LEU . 10.5 t80 -63.17 -53.95 45.31 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.045 -1.034 . . . . 0.0 109.235 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.899 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.69 -46.21 66.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.975 ' CB ' ' HB2' ' B' ' 75' ' ' ALA . . . -56.18 -31.54 63.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.038 -1.039 . . . . 0.0 109.04 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.787 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -64.6 -65.05 0.73 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.787 HG23 ' CE2' ' A' ' 76' ' ' PHE . 41.3 t -56.55 -18.71 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.881 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -65.46 -48.92 71.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.353 -0.842 . . . . 0.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.9 OUTLIER -74.98 -64.16 1.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.354 -0.841 . . . . 0.0 109.745 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 1.013 HG22 HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.01 -22.01 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 O-C-N 120.407 -1.433 . . . . 0.0 109.627 -178.824 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.715 ' CG2' HD11 ' B' ' 11' ' ' ILE . 4.6 m -80.62 -65.8 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.91 -1.119 . . . . 0.0 108.876 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.7 t -80.1 -49.7 11.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.158 -0.963 . . . . 0.0 108.922 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.68 -33.77 0.08 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.607 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 82' ' ' THR . 11.9 t -74.17 -50.89 17.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.354 -0.841 . . . . 0.0 109.351 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -53.44 -55.69 23.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.922 . . . . 0.0 109.45 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -38.55 83.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 0.0 109.471 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.862 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -58.25 -75.13 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.254 -0.903 . . . . 0.0 109.66 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.807 HD21 ' HZ ' ' A' ' 73' ' ' PHE . 1.3 mt -75.58 -30.6 59.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 0.0 109.651 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 7' ' ' MET . 16.9 mt-10 -57.36 -59.1 5.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -0.954 . . . . 0.0 109.301 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' B' ' 1' ' ' SER . 1.0 OUTLIER -60.71 -49.66 76.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.291 -0.881 . . . . 0.0 109.378 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.562 ' HB1' HD12 ' A' ' 10' ' ' LEU . . . -66.0 -9.83 33.99 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.274 -0.891 . . . . 0.0 109.449 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' B' ' 3' ' ' LEU . 2.6 ttp -80.71 -53.84 6.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.436 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.97 -36.44 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.373 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.12 -46.72 64.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.203 -0.936 . . . . 0.0 109.469 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.587 ' HB3' ' HE1' ' B' ' 74' ' ' MET . 6.3 mt -61.3 -66.84 0.47 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.903 . . . . 0.0 109.427 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.715 HD11 ' CG2' ' A' ' 81' ' ' THR . 61.3 mt -41.76 -40.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.402 -0.811 . . . . 0.0 109.327 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 29.7 t70 -58.59 -54.06 51.37 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.26 -0.9 . . . . 0.0 109.066 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.692 HG21 HD13 ' A' ' 3' ' ' LEU . 1.7 t -51.5 -25.94 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.375 -0.828 . . . . 0.0 109.504 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.58 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 10.0 t80 -72.08 -46.39 57.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.897 -1.127 . . . . 0.0 109.666 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.522 ' NE2' ' HD3' ' B' ' 24' ' ' LYS . 43.9 t-80 -78.04 -14.68 59.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.262 -0.899 . . . . 0.0 110.454 -179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.525 ' O ' ' CG ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -90.41 -60.16 2.0 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.947 -1.096 . . . . 0.0 109.287 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.579 ' CD2' ' OE1' ' B' ' 34' ' ' GLU . 24.6 m-85 -61.63 -33.23 73.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.522 -0.736 . . . . 0.0 109.623 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.531 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 4.2 p -82.87 -11.35 58.28 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.172 -0.955 . . . . 0.0 109.658 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -102.77 9.31 55.26 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.525 ' CG ' ' O ' ' B' ' 16' ' ' GLN . 11.0 mtp85 -89.98 -33.95 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -1.159 . . . . 0.0 109.476 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.476 ' HG2' ' OE2' ' B' ' 31' ' ' GLU . 5.6 pt-20 -170.17 117.44 0.55 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.905 . . . . 0.0 109.384 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.54 -81.13 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' B' ' 24' ' ' LYS . 3.2 p30 -171.57 28.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -1.147 . . . . 0.0 109.555 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.522 ' HD3' ' NE2' ' B' ' 15' ' ' HIS . 1.6 ttmt 43.65 61.2 2.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.893 . . . . 0.0 109.508 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.508 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.2 OUTLIER -170.1 -34.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 0.0 109.678 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.531 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.0 OUTLIER -141.12 165.25 28.05 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.203 -0.935 . . . . 0.0 109.708 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 1.08 HD12 HD23 ' B' ' 32' ' ' LEU . 17.8 mt -87.77 148.76 24.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.303 -0.873 . . . . 0.0 109.262 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -116.55 72.64 0.82 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.688 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 62.32 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.461 -0.775 . . . . 0.0 110.578 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 0.3 OUTLIER -48.32 -37.52 16.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.197 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.665 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.9 mm-40 -58.27 -41.22 83.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.085 -1.009 . . . . 0.0 109.48 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 1.08 HD23 HD12 ' B' ' 27' ' ' LEU . 18.8 mt -64.46 -57.13 10.11 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.524 -0.735 . . . . 0.0 109.496 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 1.127 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.89 -68.78 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.252 -0.905 . . . . 0.0 110.055 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.579 ' OE1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -42.74 -49.82 5.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 109.779 -179.421 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.831 HD23 ' CE2' ' B' ' 76' ' ' PHE . 14.1 tp -49.12 -47.54 45.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.004 -1.06 . . . . 0.0 109.555 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.961 HD13 HG22 ' B' ' 53' ' ' VAL . 2.9 mt -63.84 -32.66 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' GLU . 9.2 m120 -94.46 -77.33 0.46 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.05 . . . . 0.0 109.731 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.418 ' C ' ' O ' ' B' ' 37' ' ' ASN . 5.0 t-20 -42.68 -26.42 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.329 -0.857 . . . . 0.0 109.902 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.713 ' HG2' HD13 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -109.31 -46.24 3.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.084 -1.01 . . . . 0.0 109.922 -179.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.531 ' CB ' ' O ' ' B' ' 36' ' ' ILE . 0.7 OUTLIER -104.89 61.65 0.7 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.065 -1.022 . . . . 0.0 109.503 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 1.001 HD13 HG21 ' B' ' 53' ' ' VAL . 29.7 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 83.1 -42.73 0.1 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.686 -0.634 . . . . 0.0 109.725 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.0 OUTLIER 179.55 -44.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.139 -0.976 . . . . 0.0 109.203 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.6 OUTLIER 162.36 58.52 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.362 -0.836 . . . . 0.0 109.243 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -90.42 -70.35 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.201 -0.937 . . . . 0.0 109.899 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.816 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.7 t -87.64 -20.89 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.094 -1.004 . . . . 0.0 109.601 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.127 HG11 ' CD ' ' B' ' 33' ' ' LYS . 54.7 t -76.9 -29.59 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.955 -1.091 . . . . 0.0 109.224 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.3 OUTLIER -90.11 -29.55 18.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.259 -0.901 . . . . 0.0 109.546 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -35.18 35.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.632 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 52' ' ' VAL . 11.1 m -58.63 -47.08 89.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 O-C-N 121.13 -0.981 . . . . 0.0 109.919 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' B' ' 57' ' ' MET . 8.2 tpp -42.01 -28.33 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.014 -1.054 . . . . 0.0 109.14 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 1.7 mp0 -80.71 -45.39 17.19 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.457 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.6 m -73.53 -67.21 0.61 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.405 -0.809 . . . . 0.0 109.39 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.973 HD22 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mt -40.61 -33.87 0.31 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.481 -0.762 . . . . 0.0 109.341 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 57' ' ' MET . 4.7 t0 -90.17 83.95 6.06 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.419 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -96.1 26.92 3.9 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.266 -0.896 . . . . 0.0 109.577 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.448 ' OD2' ' OD2' ' B' ' 69' ' ' ASP . 13.1 m-20 -127.93 -34.17 2.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 109.5 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.15 91.47 1.34 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 177.04 -32.71 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.219 -1.165 . . . . 0.0 108.669 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.13 26.49 4.9 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' B' ' 26' ' ' LYS . 23.8 pt-20 -136.43 124.46 22.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.236 -1.155 . . . . 0.0 109.374 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.57 166.05 19.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.188 -0.945 . . . . 0.0 110.009 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.6 OUTLIER -129.21 172.23 11.66 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.549 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -61.27 -52.66 63.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.489 -179.555 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.439 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.8 OUTLIER -56.34 -34.77 66.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.133 -0.98 . . . . 0.0 109.225 -179.588 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.535 ' CA ' ' OE1' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -81.49 -20.2 40.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 108.877 179.561 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.613 ' CE1' HG12 ' B' ' 13' ' ' VAL . 3.9 t80 -65.7 -51.04 62.53 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.881 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -69.11 -46.15 68.41 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.279 -0.888 . . . . 0.0 108.902 179.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.975 ' HB2' ' CB ' ' A' ' 75' ' ' ALA . . . -64.74 -18.13 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.171 -0.956 . . . . 0.0 108.87 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.973 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -72.62 -62.78 1.33 Allowed 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.662 ' O ' HG23 ' B' ' 81' ' ' THR . 96.1 t -60.56 -27.58 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.899 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -69.26 -30.58 68.73 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.584 -0.697 . . . . 0.0 109.229 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.71 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 2.4 mmm -76.28 -71.05 0.41 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.17 -0.956 . . . . 0.0 108.643 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.753 HG11 HG12 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -44.6 -24.99 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 O-C-N 120.66 -1.275 . . . . 0.0 109.467 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.662 HG23 ' O ' ' B' ' 77' ' ' VAL . 4.9 p -75.38 -69.61 0.47 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 0.0 108.547 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.2 m -78.01 -53.6 7.24 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -35.96 -37.04 0.1 Allowed 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.257 0.551 . . . . 0.0 109.851 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' B' ' 82' ' ' THR . 5.2 t -88.2 -38.68 15.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.272 -0.892 . . . . 0.0 109.533 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' B' ' 82' ' ' THR . 3.2 t-160 -55.41 -21.23 14.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.479 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -87.59 -37.93 16.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.923 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 16.0 t80 . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.47 -179.979 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.43 ' HB3' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.95 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 1.9 mp0 -67.17 -73.01 0.15 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.216 -0.927 . . . . 0.0 109.455 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.672 HD21 HD23 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.52 -29.73 0.77 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.48 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 1' ' ' SER . 1.0 OUTLIER -65.72 -52.84 48.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.217 -0.927 . . . . 0.0 109.654 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -62.21 -26.1 68.17 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.209 -0.932 . . . . 0.0 109.494 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HB2' ' B' ' 6' ' ' ALA . . . -72.94 -24.41 60.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.515 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' B' ' 81' ' ' THR . 6.8 tpt -80.86 -55.84 4.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.434 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.9 p -60.97 -24.39 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.195 -0.941 . . . . 0.0 109.614 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.756 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -77.43 -66.64 0.81 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.558 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.872 HD13 HD22 ' B' ' 3' ' ' LEU . 4.1 mm? -43.82 -50.37 7.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.687 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.588 HG23 ' N ' ' A' ' 12' ' ' ASP . 17.9 tt -57.61 -45.61 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 109.604 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.588 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.07 -25.72 59.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.27 -0.894 . . . . 0.0 109.865 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.068 ' CG1' HD11 ' A' ' 35' ' ' LEU . 2.7 t -87.08 -28.15 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.1 -1.0 . . . . 0.0 109.725 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 7.1 t80 -66.3 -50.18 64.52 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.919 -1.113 . . . . 0.0 109.389 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -79.33 -31.99 43.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.25 -0.906 . . . . 0.0 109.684 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.4 tt0 -66.22 -65.59 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 109.544 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.559 ' CD1' HG13 ' A' ' 13' ' ' VAL . 19.7 m-85 -56.9 -45.0 82.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.31 -0.869 . . . . 0.0 109.604 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 18.1 m -67.8 -20.55 65.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.179 -0.951 . . . . 0.0 109.56 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.85 -7.79 76.19 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.438 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 23.8 mtp180 -70.68 -64.47 0.89 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -1.146 . . . . 0.0 109.482 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.37 170.05 11.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.278 -0.889 . . . . 0.0 109.438 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . -62.03 88.05 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER 162.07 89.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.379 -1.071 . . . . 0.0 109.307 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.42 35.14 0.76 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.259 -0.901 . . . . 0.0 109.672 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -151.13 16.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.191 -0.943 . . . . 0.0 109.682 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -170.31 168.25 8.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.124 -0.985 . . . . 0.0 109.579 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.884 HD22 ' HB3' ' A' ' 31' ' ' GLU . 89.2 mt -120.0 149.99 41.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.437 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.1 OUTLIER -105.33 94.27 5.13 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 -179.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HA ' ' SD ' ' A' ' 57' ' ' MET . 2.0 ttmt 37.01 -84.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.703 -0.623 . . . . 0.0 111.276 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.613 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.8 m -45.18 -46.96 12.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.916 -1.115 . . . . 0.0 109.919 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.884 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -45.38 -46.9 13.45 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.036 -1.04 . . . . 0.0 109.32 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.018 ' CD2' HD22 ' A' ' 60' ' ' LEU . 2.5 mp -60.81 -60.95 2.98 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.592 -0.692 . . . . 0.0 109.247 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.945 ' CD ' HG11 ' A' ' 53' ' ' VAL . 1.2 mmmm -38.93 -36.43 0.28 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.508 -0.745 . . . . 0.0 109.748 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -68.44 -61.49 1.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.111 -0.993 . . . . 0.0 109.255 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.068 HD11 ' CG1' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -41.41 -51.52 3.73 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.697 . . . . 0.0 109.882 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.051 HD13 HG22 ' A' ' 53' ' ' VAL . 53.9 mt -60.61 -50.94 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 110.435 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.558 ' ND2' ' N ' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -81.75 12.04 4.3 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.972 -1.08 . . . . 0.0 109.955 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.46 ' O ' ' OE1' ' A' ' 39' ' ' GLU . 1.4 t-20 -140.83 12.17 2.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.776 ' CB ' HD12 ' B' ' 3' ' ' LEU . 6.8 mm-40 -151.55 -35.7 0.13 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.007 -1.058 . . . . 0.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.042 HD23 ' HA ' ' A' ' 36' ' ' ILE . 2.1 mm? -44.22 -74.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.018 -1.051 . . . . 0.0 109.432 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.576 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 2.1 p . . . . . 0 N--CA 1.494 1.747 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.92 HG13 HG21 ' A' ' 53' ' ' VAL . 3.3 mm . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.29 0.567 . . . . 0.0 109.683 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -44.12 -33.27 1.44 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.501 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' A' ' 50' ' ' GLN . 15.7 tt0 -179.85 68.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.522 ' HA ' HG21 ' A' ' 47' ' ' ILE . 2.9 mt-30 43.85 56.51 4.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.506 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.14 -69.98 0.69 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.244 -0.91 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.865 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.9 t -89.24 -12.35 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.188 -0.945 . . . . 0.0 109.534 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.051 HG22 HD13 ' A' ' 36' ' ' ILE . 95.0 t -82.52 -26.26 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.123 -0.985 . . . . 0.0 109.17 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -87.49 -36.55 17.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.136 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.88 -47.29 15.33 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.378 -0.826 . . . . 0.0 109.209 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.859 ' O ' HD12 ' A' ' 60' ' ' LEU . 1.5 p -62.96 -43.41 99.0 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 O-C-N 121.194 -0.941 . . . . 0.0 109.253 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.502 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -46.09 -42.36 13.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.45 179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -57.62 12.15 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 56' ' ' VAL . 6.0 t -63.6 -12.91 37.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.231 -0.918 . . . . 0.0 109.616 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.018 HD22 ' CD2' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -79.77 -30.04 40.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -0.858 . . . . 0.0 109.452 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 61' ' ' ASP . 0.5 OUTLIER -89.92 104.73 17.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -99.94 1.14 42.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.286 -0.884 . . . . 0.0 109.585 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.91 -22.49 6.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.933 . . . . 0.0 109.527 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 85.78 99.21 0.74 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER 167.34 -27.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.272 -1.134 . . . . 0.0 108.622 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.42 -14.59 30.28 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.402 ' OE2' ' N ' ' A' ' 67' ' ' GLU . 2.7 mm-40 -79.61 111.42 15.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -1.097 . . . . 0.0 109.31 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.4 t -69.68 156.55 38.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.88 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.508 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -118.57 171.83 7.91 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.418 -0.801 . . . . 0.0 108.843 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -62.63 -51.54 66.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.17 -0.956 . . . . 0.0 110.194 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.451 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.7 mt-30 -56.03 -33.1 64.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 0.0 109.062 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 1.1 mm-40 -81.79 -22.12 37.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.388 -0.82 . . . . 0.0 109.02 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.448 ' CE2' HD12 ' A' ' 10' ' ' LEU . 37.9 t80 -66.78 -58.03 5.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.393 -0.817 . . . . 0.0 109.1 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 1.045 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 4.1 tpt -64.35 -47.96 77.35 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 109.153 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.834 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -57.05 -29.48 63.46 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.157 -0.964 . . . . 0.0 108.686 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.791 ' CD2' HG23 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -62.0 -66.19 0.58 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.488 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.791 HG23 ' CD2' ' A' ' 76' ' ' PHE . 55.1 t -55.52 -22.2 11.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -59.79 -49.16 78.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.513 -0.742 . . . . 0.0 109.154 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 20.3 mtp -76.64 -65.67 0.91 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.84 0.829 . . . . 0.0 109.664 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.865 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -47.64 -21.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 120.449 -1.407 . . . . 0.0 110.108 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 21.9 m -83.49 -63.56 1.33 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 0.0 108.612 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.586 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.3 m -79.62 -53.13 7.14 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.26 -33.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.2 0.524 . . . . 0.0 109.946 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.6 t -89.54 -41.96 11.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.476 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.429 ' N ' ' O ' ' A' ' 82' ' ' THR . 13.8 m170 -50.88 -56.44 12.27 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 109.47 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.36 -19.47 65.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 36.7 t80 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.267 -0.895 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.485 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 20.4 m . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.756 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 3.8 mm-40 -73.08 -55.12 6.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 109.257 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.876 HD11 HD21 ' A' ' 35' ' ' LEU . 2.8 mt -76.51 -11.52 59.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.847 . . . . 0.0 109.418 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 7' ' ' MET . 0.1 OUTLIER -74.61 -54.57 7.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.192 -0.942 . . . . 0.0 108.815 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -20.01 58.79 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.303 -0.873 . . . . 0.0 109.068 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.65 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -81.96 -30.47 31.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.388 -0.82 . . . . 0.0 109.568 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' B' ' 4' ' ' GLU . 1.3 ppp? -80.32 -32.01 38.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.133 -0.979 . . . . 0.0 109.392 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.428 ' N ' ' HG3' ' B' ' 7' ' ' MET . 55.4 t -73.09 -49.13 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.127 -0.983 . . . . 0.0 109.17 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.95 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -69.11 -43.91 73.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.346 -0.846 . . . . 0.0 109.613 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 3' ' ' LEU . 50.0 mt -61.96 -28.3 69.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.209 -0.932 . . . . 0.0 109.802 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.958 HD13 ' CE2' ' B' ' 70' ' ' PHE . 5.2 mm -72.16 -43.45 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.374 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 1.3 t70 -67.8 -36.9 81.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.293 -0.88 . . . . 0.0 110.161 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.901 HG13 ' O ' ' B' ' 9' ' ' ALA . 1.3 m -75.03 -34.48 32.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.046 -1.034 . . . . 0.0 110.083 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 69.5 t80 -61.76 -52.23 65.07 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.685 -1.26 . . . . 0.0 109.234 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.429 ' O ' ' C ' ' B' ' 16' ' ' GLN . 29.1 m80 -74.71 -60.46 2.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.25 -0.906 . . . . 0.0 109.755 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 2.3 tt0 -42.73 -47.21 5.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.287 -0.883 . . . . 0.0 109.684 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.735 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.0 m-85 -58.29 -52.16 66.74 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.207 -0.933 . . . . 0.0 109.056 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' B' ' 26' ' ' LYS . 12.2 m -51.86 -27.06 11.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.439 -0.788 . . . . 0.0 109.551 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . -66.95 -41.51 93.26 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 1.3 mmt180 -43.66 -48.51 7.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -1.128 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' B' ' 20' ' ' ARG . 22.0 mt-10 -162.78 148.3 12.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.278 -0.889 . . . . 0.0 109.439 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 87.87 75.98 1.28 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' B' ' 22' ' ' GLY . 2.2 m-20 43.74 -148.8 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.177 -1.19 . . . . 0.0 109.523 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -144.5 68.8 1.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.432 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.3 -38.56 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.918 . . . . 0.0 109.471 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -113.15 169.88 8.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.917 . . . . 0.0 109.401 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 31' ' ' GLU . 12.8 mt -93.97 138.73 31.76 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -0.96 . . . . 0.0 109.612 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.554 ' O ' ' CG ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER -94.46 82.65 4.05 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.382 -0.824 . . . . 0.0 109.504 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.543 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 6.8 ttmt 44.43 -91.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.113 -0.992 . . . . 0.0 110.196 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 28' ' ' LYS . 45.0 m -43.22 -36.88 1.92 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.872 -1.143 . . . . 0.0 110.071 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 27' ' ' LEU . 1.4 mp0 -43.04 -51.43 5.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.084 -1.01 . . . . 0.0 110.352 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.997 HD13 HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -74.63 -35.67 62.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.19 -0.944 . . . . 0.0 109.068 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.542 ' HD3' HG11 ' B' ' 53' ' ' VAL . 1.5 ttpt -52.15 -27.67 15.17 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.054 -1.029 . . . . 0.0 108.741 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.512 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -83.32 -52.34 6.64 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.297 -0.877 . . . . 0.0 108.828 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.882 HD22 ' CE1' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -43.12 -38.96 2.6 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.438 -0.789 . . . . 0.0 108.98 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.722 HG23 ' HB2' ' B' ' 40' ' ' LEU . 3.8 mt -78.8 -39.1 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 O-C-N 121.561 -0.712 . . . . 0.0 109.318 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.94 -0.25 20.81 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.505 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.26 -53.08 3.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.161 -0.962 . . . . 0.0 109.069 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.511 ' HG2' HD22 ' A' ' 3' ' ' LEU . 1.0 OUTLIER -105.31 -28.48 10.88 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.001 179.609 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.764 HD11 HG13 ' B' ' 77' ' ' VAL . 74.3 mt -98.02 56.32 1.22 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.406 -0.809 . . . . 0.0 109.37 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.869 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.532 HG22 ' O ' ' B' ' 47' ' ' ILE . 4.8 mt . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -76.77 3.28 12.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.132 -0.98 . . . . 0.0 109.52 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.49 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 1.2 mm-40 -123.54 14.66 9.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.209 -0.932 . . . . 0.0 108.98 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.524 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 75.04 54.21 0.07 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.397 -0.814 . . . . 0.0 109.546 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.08 -70.8 0.65 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.192 -0.943 . . . . 0.0 109.502 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.915 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -93.87 -24.31 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.108 -0.995 . . . . 0.0 108.753 179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.542 HG11 ' HD3' ' B' ' 33' ' ' LYS . 45.8 t -77.22 -17.23 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.356 -0.84 . . . . 0.0 108.869 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.524 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 41.0 t0 -84.18 -46.71 11.6 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.365 -0.835 . . . . 0.0 109.113 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -71.45 -49.8 38.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.236 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.81 HG11 HG22 ' B' ' 80' ' ' VAL . 21.4 m -54.21 -46.74 68.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.134 -0.978 . . . . 0.0 109.352 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 7.4 tpt -43.54 -44.55 6.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 109.719 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -54.43 45.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.209 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.579 HG22 ' O ' ' B' ' 56' ' ' VAL . 4.9 t -71.55 -9.09 57.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 109.542 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.997 HD22 HD13 ' B' ' 32' ' ' LEU . 0.3 OUTLIER -90.88 -10.83 41.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.37 -0.831 . . . . 0.0 109.459 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.14 82.43 6.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 109.294 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -85.01 13.17 6.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -160.76 27.29 0.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.518 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' OD1' ' B' ' 65' ' ' ASP . . . 49.94 68.5 1.37 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' B' ' 64' ' ' GLY . 0.4 OUTLIER -177.06 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.275 -1.133 . . . . 0.0 108.603 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.12 8.25 25.8 Favored Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 1.4 mt-10 -69.91 85.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -1.136 . . . . 0.0 109.455 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' B' ' 60' ' ' LEU . 4.1 m -69.95 140.79 53.07 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -100.67 172.71 6.92 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.958 ' CE2' HD13 ' B' ' 11' ' ' ILE . 0.7 OUTLIER -64.97 -58.83 5.1 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.101 -0.999 . . . . 0.0 110.463 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.81 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.2 OUTLIER -50.92 -49.67 59.14 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.166 -0.959 . . . . 0.0 109.272 -179.511 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.642 ' CB ' ' CZ ' ' B' ' 76' ' ' PHE . 1.3 mm-40 -68.06 -24.56 65.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.382 -0.824 . . . . 0.0 109.021 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.882 ' CE1' HD22 ' B' ' 35' ' ' LEU . 1.7 t80 -66.05 -60.75 2.53 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.479 -0.763 . . . . 0.0 109.606 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.82 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 2.6 mtm -53.55 -34.86 59.77 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.0 109.159 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.834 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -68.86 -34.25 75.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.12 -0.987 . . . . 0.0 108.723 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CZ ' ' CB ' ' B' ' 72' ' ' GLU . 20.4 m-30 -65.31 -66.17 0.58 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.764 HG13 HD11 ' B' ' 40' ' ' LEU . 57.4 t -47.2 -26.72 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 1.045 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -56.95 -64.72 0.78 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 6.0 mtm -56.86 -61.91 2.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.197 -0.939 . . . . 0.0 109.408 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.915 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.35 -22.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 O-C-N 120.66 -1.275 . . . . 0.0 109.528 -179.183 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.533 ' CG2' ' CE ' ' A' ' 7' ' ' MET . 30.2 m -79.0 -69.46 0.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.929 -1.107 . . . . 0.0 109.055 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.3 t -76.41 -48.89 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.142 -0.974 . . . . 0.0 109.073 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.91 -35.16 0.09 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.749 -0.594 . . . . 0.0 110.022 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.7 t -89.64 -37.49 14.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -0.964 . . . . 0.0 109.712 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 85' ' ' HIS . 1.3 t60 -64.96 -12.12 46.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.205 -0.935 . . . . 0.0 109.551 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.5 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 5.6 pt-20 -90.15 -33.96 16.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 0.0 109.6 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . 0.488 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.5 t80 . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.507 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 49.7 m . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.516 ' HG3' ' CG2' ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.26 -95.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.895 . . . . 0.0 109.66 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.765 HD13 HG21 ' B' ' 13' ' ' VAL . 7.3 mp -47.23 -29.31 2.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.1 -1.0 . . . . 0.0 109.739 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.449 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.5 OUTLIER -52.14 -60.4 3.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.148 -0.97 . . . . 0.0 109.172 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -35.01 79.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.329 -0.857 . . . . 0.0 109.018 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.887 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -69.87 -10.76 59.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.88 -47.61 7.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.303 -0.873 . . . . 0.0 109.196 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.439 ' O ' HG22 ' A' ' 11' ' ' ILE . 52.4 t -64.68 -27.16 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.304 -0.873 . . . . 0.0 109.233 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.625 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -85.54 -58.29 2.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.341 -0.849 . . . . 0.0 109.366 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.8 mt -49.14 -34.28 13.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 0.0 109.337 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.602 HG23 ' N ' ' A' ' 12' ' ' ASP . 3.3 tt -76.21 -46.06 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 109.53 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -55.12 -21.32 12.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.331 -0.855 . . . . 0.0 109.552 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.661 HG22 ' HE2' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.13 -39.63 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.141 -0.974 . . . . 0.0 109.674 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 25.3 t80 -53.73 -41.92 67.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.819 -1.175 . . . . 0.0 108.858 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -79.25 -44.43 21.78 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.341 -0.849 . . . . 0.0 109.205 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' A' ' 15' ' ' HIS . 1.7 tt0 -44.4 -38.93 4.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.268 -0.895 . . . . 0.0 108.82 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.79 ' CE2' HD21 ' A' ' 35' ' ' LEU . 80.8 m-85 -94.08 -78.04 0.44 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.525 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 24.4 p 39.05 28.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.594 -0.691 . . . . 0.0 110.006 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' TYR . . . 76.9 51.82 6.12 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 17' ' ' TYR . 32.7 mtp180 -40.65 -29.52 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.5 -1.0 . . . . 0.0 109.732 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -98.5 85.89 3.47 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.237 -0.915 . . . . 0.0 109.428 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 103.69 91.87 2.22 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 9.8 t70 70.94 154.97 0.14 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.199 -1.177 . . . . 0.0 109.402 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.525 ' CA ' ' OG ' ' A' ' 18' ' ' SER . 10.9 mttp -134.64 60.44 1.7 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.514 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t-80 -130.42 -35.18 1.54 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.21 -0.931 . . . . 0.0 109.558 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.543 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -140.83 167.43 22.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.4 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD12 ' CD2' ' A' ' 32' ' ' LEU . 9.0 mt -88.92 170.06 11.03 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.138 -0.976 . . . . 0.0 109.719 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 2.6 ptmm? -138.92 71.12 1.38 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.375 -0.828 . . . . 0.0 109.238 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 64.9 -83.08 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.581 -0.699 . . . . 0.0 110.225 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 91.0 p -41.98 -55.57 3.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.559 ' OE1' ' CD1' ' A' ' 17' ' ' TYR . 2.8 mm-40 -45.92 -45.82 15.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.028 . . . . 0.0 108.717 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.81 HD12 ' SD ' ' A' ' 57' ' ' MET . 16.3 mt -52.14 -68.25 0.19 Allowed 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.717 ' HG2' HG11 ' A' ' 53' ' ' VAL . 19.3 mttt -38.27 -31.08 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.558 -0.714 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 31' ' ' GLU . 7.9 mm-40 -67.45 -67.61 0.44 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.085 -1.01 . . . . 0.0 109.169 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.79 HD21 ' CE2' ' A' ' 17' ' ' TYR . 18.6 mt -43.85 -45.69 7.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.337 -0.852 . . . . 0.0 109.461 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.12 HD11 ' CE1' ' A' ' 76' ' ' PHE . 44.7 mm -54.05 -62.0 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.384 -0.822 . . . . 0.0 109.672 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.411 ' C ' ' OD1' ' A' ' 38' ' ' ASN . 10.8 m120 -83.08 16.7 2.25 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.34 -0.85 . . . . 0.0 110.162 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m120 -142.06 16.94 2.1 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.037 -1.04 . . . . 0.0 109.742 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.952 ' OE2' HG13 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -158.4 -33.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.955 -1.091 . . . . 0.0 110.563 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.755 HD22 ' OE2' ' A' ' 39' ' ' GLU . 2.0 mm? -53.49 -68.94 0.13 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.926 -1.109 . . . . 0.0 109.644 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.499 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 1.048 HD13 HG21 ' A' ' 53' ' ' VAL . 1.2 mt . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 17.1 ptpt -40.1 -35.44 0.39 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.463 -0.773 . . . . 0.0 109.873 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 11.8 pt-20 178.13 -31.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.855 . . . . 0.0 109.435 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.555 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mt-30 165.17 50.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.328 -0.857 . . . . 0.0 109.147 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -90.32 -70.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.895 . . . . 0.0 110.135 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.775 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.7 OUTLIER -86.2 -23.37 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.127 -0.983 . . . . 0.0 109.954 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.048 HG21 HD13 ' A' ' 47' ' ' ILE . 83.7 t -81.69 -32.16 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 120.793 -1.192 . . . . 0.0 109.405 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.555 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -90.58 -28.35 18.52 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.188 -0.945 . . . . 0.0 109.499 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 10.3 tptm -87.34 -42.48 12.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.713 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -73.93 -29.8 26.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.118 -0.989 . . . . 0.0 109.127 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.81 ' SD ' HD12 ' A' ' 32' ' ' LEU . 6.9 tpt -49.42 -39.33 32.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.359 -0.838 . . . . 0.0 109.48 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.33 -48.2 20.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.859 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 3.9 t -66.1 -9.53 31.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.891 HD11 HG13 ' A' ' 56' ' ' VAL . 35.2 mt -82.68 -52.83 6.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 109.347 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.62 ' OD2' ' HE2' ' A' ' 57' ' ' MET . 1.0 OUTLIER -75.76 86.9 2.77 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.49 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.64 25.72 2.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 109.428 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -121.8 -27.76 4.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.46 94.67 1.02 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.7 -31.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.267 -1.137 . . . . 0.0 108.576 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.11 -23.91 19.92 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.543 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 4.8 mm-40 -83.94 136.7 33.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.22 -1.165 . . . . 0.0 109.409 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.529 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.84 170.47 13.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.223 -0.923 . . . . 0.0 109.927 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.4 OUTLIER -136.78 171.4 14.56 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.481 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.5 OUTLIER -61.4 -62.2 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.799 -1.188 . . . . 0.0 110.354 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.697 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 0.9 OUTLIER -47.79 -28.67 2.66 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.034 -1.041 . . . . 0.0 108.918 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.529 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -73.22 -43.13 61.77 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.548 -0.72 . . . . 0.0 109.64 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.608 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 29.2 t80 -56.24 -54.36 46.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.875 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -56.4 -58.19 9.08 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.047 -1.033 . . . . 0.0 109.344 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -57.75 -17.38 15.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.2 -0.938 . . . . 0.0 108.975 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 1.12 ' CE1' HD11 ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.66 -70.43 0.32 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.457 -0.777 . . . . 0.0 109.138 179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.952 HG13 ' OE2' ' A' ' 39' ' ' GLU . 46.5 t -52.23 -29.52 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.427 -0.795 . . . . 0.0 109.188 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.22 -41.95 96.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.28 -0.888 . . . . 0.0 109.709 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.693 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.3 mtm -78.19 -70.42 0.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 109.73 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.898 HG11 HD12 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -43.82 -23.96 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.472 -1.393 . . . . 0.0 109.695 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.586 ' N ' HD11 ' A' ' 40' ' ' LEU . 16.8 m -80.34 -68.13 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.0 108.871 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.2 t -77.51 -49.3 15.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.181 -0.949 . . . . 0.0 108.796 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.05 -43.34 0.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.05 -28.76 18.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.314 -0.866 . . . . 0.0 109.607 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 81' ' ' THR . 16.5 t-160 -69.65 -9.69 55.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.907 . . . . 0.0 109.592 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.44 -10.16 50.08 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.203 -0.936 . . . . 0.0 109.497 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 0.0 109.547 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.462 ' HB3' ' HB2' ' B' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.625 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -59.68 -72.53 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.196 -0.94 . . . . 0.0 109.833 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.75 HD22 ' N ' ' B' ' 3' ' ' LEU . 3.6 mm? -73.69 -31.64 63.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.0 109.89 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.462 ' HB2' ' HB3' ' B' ' 1' ' ' SER . 3.3 tt0 -56.97 -58.92 6.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.212 -0.93 . . . . 0.0 109.389 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -64.36 -31.09 72.16 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.86 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -75.97 -14.01 60.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.0 109.507 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.539 ' O ' HD12 ' B' ' 11' ' ' ILE . 2.4 mtp -86.87 -37.75 17.4 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 24.6 t -73.83 -34.64 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -0.907 . . . . 0.0 109.397 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.76 -43.27 37.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.663 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.677 HD13 ' CZ ' ' B' ' 73' ' ' PHE . 3.4 mm? -66.47 -55.46 15.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.539 HD12 ' O ' ' B' ' 7' ' ' MET . 45.0 mt -52.35 -47.8 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -0.858 . . . . 0.0 109.72 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -63.16 -33.74 76.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.607 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.779 ' CG1' HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -73.53 -15.69 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.224 -0.923 . . . . 0.0 109.339 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 13.4 t80 -82.89 -44.98 14.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.965 -1.084 . . . . 0.0 108.981 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.456 ' O ' ' OG ' ' B' ' 18' ' ' SER . 75.1 m-70 -66.24 -31.21 71.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.411 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.492 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 4.2 tt0 -81.04 -50.46 9.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.158 -0.964 . . . . 0.0 109.407 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.861 ' O ' HD22 ' B' ' 27' ' ' LEU . 10.0 m-85 -78.68 4.03 14.8 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.308 -0.87 . . . . 0.0 109.574 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.554 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.1 p -83.36 41.45 0.77 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.194 -0.941 . . . . 0.0 109.76 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . 103.99 55.67 0.77 Allowed Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' B' ' 16' ' ' GLN . 11.9 mtp85 -45.02 -26.39 0.43 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.31 -1.112 . . . . 0.0 109.132 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -132.06 117.22 18.08 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.327 -0.858 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.04 -109.62 3.76 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -63.62 178.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 109.421 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' B' ' 18' ' ' SER . 15.4 ttmm -161.51 56.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.517 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -161.64 -36.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.587 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.482 ' C ' HD23 ' B' ' 27' ' ' LEU . 33.1 mtmt -131.67 170.16 15.16 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.144 -0.972 . . . . 0.0 109.481 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.861 HD22 ' O ' ' B' ' 17' ' ' TYR . 4.0 mt -95.29 142.9 27.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.172 -0.955 . . . . 0.0 109.918 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.523 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 9.4 pttp -124.32 74.29 1.3 Allowed 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.418 -0.801 . . . . 0.0 108.874 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.678 ' HA ' HD12 ' B' ' 32' ' ' LEU . 4.6 tppt? 68.3 -81.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.692 -0.63 . . . . 0.0 110.283 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -49.47 -46.02 47.52 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.083 -1.011 . . . . 0.0 110.406 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' CG ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -58.18 -34.64 70.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.0 -1.062 . . . . 0.0 109.618 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.807 HD23 HD12 ' B' ' 27' ' ' LEU . 12.1 mt -67.98 -69.57 0.31 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.478 -0.763 . . . . 0.0 109.51 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.477 ' HG3' HG11 ' B' ' 53' ' ' VAL . 8.8 mtpt -40.76 -27.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.396 -0.815 . . . . 0.0 110.171 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.498 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.5 OUTLIER -76.91 -58.75 3.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.034 -1.041 . . . . 0.0 109.424 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.807 HD21 ' CE1' ' B' ' 73' ' ' PHE . 23.4 tp -41.37 -47.16 3.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.716 HG23 HD12 ' B' ' 40' ' ' LEU . 1.3 mp -78.16 -38.95 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.0 110.082 -179.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' B' ' 33' ' ' LYS . 2.1 m-80 -80.29 4.53 17.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.927 -1.108 . . . . 0.0 110.044 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.465 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 1.0 OUTLIER -126.68 -16.08 5.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.09 -1.006 . . . . 0.0 109.937 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 64.9 mm-40 -123.86 -9.74 7.76 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.109 -0.995 . . . . 0.0 109.633 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.716 HD12 HG23 ' B' ' 36' ' ' ILE . 37.0 mt -117.29 67.17 0.74 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.199 -0.938 . . . . 0.0 109.685 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 O-C-N 121.336 -0.852 . . . . 0.0 109.087 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.695 HD12 HG23 ' B' ' 53' ' ' VAL . 24.6 mm . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 5.8 mttt 83.09 -42.67 0.1 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.692 -0.63 . . . . 0.0 109.713 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.8 OUTLIER 164.52 -25.26 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.097 -1.002 . . . . 0.0 109.368 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.511 ' HB2' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 165.11 51.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.265 -0.897 . . . . 0.0 109.574 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.478 ' OE1' ' HE3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.14 -70.66 0.66 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.135 -0.978 . . . . 0.0 109.558 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.776 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.4 t -90.85 -24.79 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.231 -0.918 . . . . 0.0 108.982 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.695 HG23 HD12 ' B' ' 47' ' ' ILE . 69.7 t -72.39 -22.22 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.283 -0.885 . . . . 0.0 108.928 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.511 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 7.6 t70 -86.91 -53.47 4.88 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.302 -0.874 . . . . 0.0 109.111 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.47 -42.52 78.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.287 -0.883 . . . . 0.0 109.122 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.905 ' HB ' HD13 ' B' ' 60' ' ' LEU . 35.2 m -61.85 -47.36 93.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 O-C-N 121.235 -0.915 . . . . 0.0 109.196 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.606 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.08 -27.62 0.22 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.4 OUTLIER -77.58 -47.44 19.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.336 -0.853 . . . . 0.0 108.699 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.454 ' O ' ' C ' ' B' ' 60' ' ' LEU . 9.2 m -76.26 -66.44 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.378 -0.826 . . . . 0.0 109.095 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.905 HD13 ' HB ' ' B' ' 56' ' ' VAL . 1.5 mp -39.9 -30.16 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.51 -0.744 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' B' ' 59' ' ' THR . 48.9 t0 -90.21 110.68 21.71 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.232 -0.918 . . . . 0.0 109.425 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -141.98 25.5 1.93 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -0.955 . . . . 0.0 109.531 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.62 -15.54 8.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 90.33 55.31 1.97 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 8.0 t70 179.28 -33.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.228 -1.16 . . . . 0.0 108.634 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.428 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.1 34.34 2.37 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.476 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 7.2 mm-40 -104.87 114.44 28.64 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -1.147 . . . . 0.0 109.434 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.555 ' HB2' HD21 ' B' ' 32' ' ' LEU . 12.0 t -70.1 158.31 35.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.278 -0.889 . . . . 0.0 109.617 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -132.05 171.18 13.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.405 -0.809 . . . . 0.0 108.924 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.471 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -53.2 -48.36 68.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.321 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.435 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.0 pt20 -59.27 -36.01 74.75 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.345 -0.847 . . . . 0.0 108.826 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.489 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.6 OUTLIER -82.23 -12.34 58.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.409 -0.807 . . . . 0.0 109.217 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.807 ' CE1' HD21 ' B' ' 35' ' ' LEU . 3.8 t80 -73.11 -57.92 3.68 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.851 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 46.4 mtt -68.31 -44.33 75.66 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.388 -0.82 . . . . 0.0 109.332 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.82 -40.6 89.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -0.876 . . . . 0.0 109.406 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.883 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.2 t80 -57.43 -68.73 0.21 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.271 -0.893 . . . . 0.0 109.131 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.649 HG13 HD21 ' B' ' 40' ' ' LEU . 71.2 t -52.45 -22.69 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -62.07 -50.87 70.25 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.56 -0.713 . . . . 0.0 109.206 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 29.7 mtp -74.01 -66.92 0.66 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.43 -0.794 . . . . 0.0 109.366 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.757 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -42.59 -25.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.502 -1.374 . . . . 0.0 109.631 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.494 ' N ' ' O ' ' B' ' 79' ' ' MET . 5.9 m -78.63 -70.01 0.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.982 -1.074 . . . . 0.0 108.722 178.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.562 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.1 t -77.82 -49.07 15.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.226 -0.921 . . . . 0.0 108.765 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -39.39 -44.09 1.29 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.684 -0.635 . . . . 0.0 109.543 179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 46.4 t -73.27 -40.37 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.861 . . . . 0.0 109.478 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.17 -13.49 48.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.22 -0.925 . . . . 0.0 109.398 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -77.23 -40.57 44.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.46 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.467 ' HG2' ' CB ' ' B' ' 9' ' ' ALA . 41.4 tt0 -80.29 -61.75 1.88 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.446 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.971 HD11 HD13 ' B' ' 10' ' ' LEU . 12.1 tp -64.43 -11.09 29.75 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.269 -0.895 . . . . 0.0 109.473 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -89.16 -53.32 4.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.243 -0.911 . . . . 0.0 109.411 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.86 -27.28 63.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.911 . . . . 0.0 109.373 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -70.2 -32.67 70.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.412 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.589 ' HE1' ' HG ' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -71.33 -43.33 67.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.0 t -71.45 -28.4 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.0 109.656 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -78.39 -68.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.927 . . . . 0.0 109.581 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.846 ' CD2' HD13 ' B' ' 3' ' ' LEU . 81.4 mt -43.71 -48.51 7.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.591 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.86 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -58.97 -44.45 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.867 . . . . 0.0 109.633 -179.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.54 ' N ' HG23 ' A' ' 11' ' ' ILE . 5.8 t70 -66.65 -19.2 65.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 110.063 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.082 HG11 HD11 ' A' ' 35' ' ' LEU . 2.7 t -88.58 -29.51 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.03 -1.044 . . . . 0.0 109.607 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -71.33 -46.06 61.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.824 -1.172 . . . . 0.0 109.12 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' ' HG2' ' A' ' 24' ' ' LYS . 16.4 t-80 -77.8 -34.71 51.99 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.538 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -68.94 -63.83 0.98 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.919 . . . . 0.0 109.418 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.843 ' CD1' HG13 ' A' ' 13' ' ' VAL . 36.7 m-85 -53.73 -38.52 64.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.251 -0.905 . . . . 0.0 109.435 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 18.7 m -68.39 -30.97 70.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.17 -0.956 . . . . 0.0 109.492 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.462 ' HA2' ' HG3' ' A' ' 24' ' ' LYS . . . -57.22 -19.06 30.6 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.6 mmt180 -72.3 -38.06 68.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.248 -1.148 . . . . 0.0 109.444 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.472 ' OE2' ' HB2' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -78.26 164.15 25.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.242 -0.912 . . . . 0.0 109.491 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -50.51 -51.91 30.65 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.472 ' HB2' ' OE2' ' A' ' 21' ' ' GLU . 42.5 m-20 -78.17 -173.35 3.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -1.169 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HG3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -142.08 56.06 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 109.449 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.506 ' CG ' ' O ' ' A' ' 25' ' ' HIS . 76.0 t60 -169.99 32.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 109.483 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 9.2 ptpt -170.03 170.31 7.61 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.197 -0.94 . . . . 0.0 109.524 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.887 HD22 ' HB3' ' A' ' 31' ' ' GLU . 87.4 mt -134.64 129.96 35.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 109.78 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 1.034 ' O ' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -78.75 166.51 22.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.181 -0.95 . . . . 0.0 108.763 179.266 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.478 ' CG ' ' SD ' ' A' ' 57' ' ' MET . 11.3 mttt -42.65 -27.22 0.16 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 0.0 109.672 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -77.59 -58.38 3.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.968 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.887 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.6 mm-40 -46.76 -42.83 17.5 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.087 -1.008 . . . . 0.0 109.296 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.034 HD12 ' O ' ' A' ' 28' ' ' LYS . 1.7 mp -59.03 -65.87 0.6 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.558 -0.714 . . . . 0.0 109.204 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.701 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -41.58 -32.09 0.33 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.311 -0.868 . . . . 0.0 109.685 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -67.48 -61.73 1.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.212 -0.93 . . . . 0.0 109.468 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.082 HD11 HG11 ' A' ' 13' ' ' VAL . 2.0 mm? -40.92 -51.35 3.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.912 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.929 HG21 HD11 ' A' ' 47' ' ' ILE . 46.6 mt -62.07 -44.17 98.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 110.025 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HG12 ' A' ' 47' ' ' ILE . 72.7 m-20 -88.13 9.93 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.0 109.954 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 1.7 t-20 -105.62 -26.39 11.87 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.118 -0.989 . . . . 0.0 109.085 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.986 ' OE2' HD13 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -134.88 -35.3 0.87 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.405 -0.809 . . . . 0.0 109.547 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.685 HD12 ' N ' ' A' ' 40' ' ' LEU . 7.8 mp -86.32 15.1 5.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.569 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.929 HD11 HG21 ' A' ' 36' ' ' ILE . 34.8 mm . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.505 ' CG ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 43.81 -81.99 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.933 0.873 . . . . 0.0 110.478 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 47' ' ' ILE . 13.4 mm-40 -46.02 -33.55 3.47 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.523 ' HA ' ' CG2' ' A' ' 47' ' ' ILE . 1.3 tt0 76.4 32.88 0.56 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 109.351 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 55' ' ' LYS . 3.3 mm-40 -72.69 -49.49 31.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.529 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.814 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.3 OUTLIER -91.52 -18.16 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.197 -0.939 . . . . 0.0 109.37 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.777 ' CG2' HG21 ' A' ' 47' ' ' ILE . 25.1 t -82.0 -37.84 15.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 120.793 -1.192 . . . . 0.0 109.022 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.09 -29.66 17.18 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.983 -1.073 . . . . 0.0 109.3 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 25.1 tttm -90.91 -35.51 14.69 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.321 -0.862 . . . . 0.0 110.559 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.716 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -90.52 -25.64 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 120.846 -1.159 . . . . 0.0 110.361 -178.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.838 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -71.96 -49.62 35.78 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.848 -1.157 . . . . 0.0 109.22 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -35.84 74.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.12 -0.988 . . . . 0.0 108.82 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 5.6 t -90.31 -9.83 46.35 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.443 -0.785 . . . . 0.0 109.422 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -65.89 -45.96 80.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.368 -0.833 . . . . 0.0 109.448 -179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.429 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 9.0 m-20 -61.34 88.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.42 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -71.63 -10.27 59.52 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 0.0 109.504 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.78 -37.29 10.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.516 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 97.78 93.37 1.93 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 39.1 t0 178.61 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.269 -1.136 . . . . 0.0 108.658 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 110.18 19.08 8.24 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 26' ' ' LYS . 53.5 mt-10 -127.15 129.25 47.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -1.137 . . . . 0.0 109.47 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 8.6 t -69.74 155.54 40.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.639 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.503 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -126.17 171.44 10.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -61.47 -50.46 72.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.124 -0.985 . . . . 0.0 110.501 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' HG2' ' B' ' 79' ' ' MET . 2.8 pt20 -58.4 -40.09 81.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.947 . . . . 0.0 108.836 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.521 ' HG3' HD23 ' A' ' 60' ' ' LEU . 1.1 tt0 -80.6 -12.24 59.54 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.477 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 19.3 t80 -69.94 -51.99 28.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.197 -0.94 . . . . 0.0 108.503 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.833 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 26.9 mtt -68.98 -43.47 74.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.957 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -67.33 -20.32 65.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 108.652 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.704 ' HE1' HD11 ' A' ' 36' ' ' ILE . 1.1 t80 -68.13 -57.95 5.24 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.651 HG21 HD12 ' B' ' 3' ' ' LEU . 55.0 t -66.86 -25.87 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 121.334 -0.854 . . . . 0.0 108.758 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -68.51 -27.27 65.97 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.429 -0.795 . . . . 0.0 109.065 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.66 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 11.6 mtm -84.2 -70.09 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 108.971 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.814 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -45.65 -23.02 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 O-C-N 120.302 -1.498 . . . . 0.0 109.892 -179.658 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.564 HG23 ' N ' ' A' ' 82' ' ' THR . 4.0 t -85.25 -52.26 6.03 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.747 -1.221 . . . . 0.0 109.327 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.619 HG21 ' HB3' ' B' ' 70' ' ' PHE . 1.1 t -90.82 -51.31 5.43 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.705 -1.221 . . . . 0.0 107.705 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.02 -42.06 0.39 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.369 0.604 . . . . 0.0 109.628 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.42 -37.02 23.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.289 -0.882 . . . . 0.0 109.428 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.422 ' N ' ' O ' ' A' ' 82' ' ' THR . 2.8 t-160 -60.19 -16.15 30.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -85.89 -38.36 18.14 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.219 -0.926 . . . . 0.0 109.43 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 0.0 109.451 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.504 ' HG3' ' CG2' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -45.52 -71.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.255 -0.903 . . . . 0.0 109.622 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 1.005 ' CD2' HG21 ' A' ' 13' ' ' VAL . 4.0 mm? -57.6 -20.22 31.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.278 -0.889 . . . . 0.0 109.816 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -62.58 -62.38 1.78 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.196 -0.94 . . . . 0.0 109.521 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -59.39 -40.38 86.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.272 -0.892 . . . . 0.0 109.661 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -68.45 -20.23 64.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.196 -0.94 . . . . 0.0 109.566 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.647 ' O ' HD12 ' B' ' 11' ' ' ILE . 0.0 OUTLIER -74.98 -59.37 2.77 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.548 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.663 HG12 ' OD2' ' B' ' 12' ' ' ASP . 3.4 t -76.52 -11.39 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 109.473 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.696 ' O ' HG13 ' B' ' 13' ' ' VAL . . . -81.85 -68.41 0.7 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.265 -0.897 . . . . 0.0 109.533 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.971 HD13 HD11 ' A' ' 3' ' ' LEU . 3.5 mm? -62.23 -30.09 70.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.431 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.647 HD12 ' O ' ' B' ' 7' ' ' MET . 74.2 mt -69.85 -47.55 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.903 -1.123 . . . . 0.0 108.785 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.663 ' OD2' HG12 ' B' ' 8' ' ' VAL . 0.5 OUTLIER -53.62 -37.86 63.47 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.94 HG11 HD13 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -72.99 -40.41 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 O-C-N 121.136 -0.978 . . . . 0.0 109.495 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 5.9 t80 -45.61 -47.21 14.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.836 -1.165 . . . . 0.0 108.224 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -80.3 -26.93 38.62 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.436 -0.79 . . . . 0.0 109.551 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -68.06 -70.15 0.28 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.995 . . . . 0.0 108.915 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 1.0 ' CD2' HD22 ' B' ' 35' ' ' LEU . 40.3 m-85 -49.71 -48.79 49.66 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.333 -0.854 . . . . 0.0 109.319 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 81.2 p -56.33 -35.35 67.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 109.716 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.455 ' HA2' ' HG2' ' B' ' 24' ' ' LYS . . . -66.58 -36.25 91.12 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 2.5 mmt180 -44.01 -28.29 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.276 -1.131 . . . . 0.0 109.513 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.475 ' HB3' ' HE3' ' B' ' 28' ' ' LYS . 5.9 mm-40 -126.64 156.11 41.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.452 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.43 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . -44.03 161.49 0.07 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.441 ' HB2' ' NZ ' ' B' ' 26' ' ' LYS . 25.6 m-20 55.18 100.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.266 -1.138 . . . . 0.0 109.447 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.455 ' HG2' ' HA2' ' B' ' 19' ' ' GLY . 15.0 mtmt -99.34 64.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.472 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.563 ' CD2' ' O ' ' B' ' 25' ' ' HIS . 16.1 t60 -139.86 8.32 2.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.221 -0.925 . . . . 0.0 109.647 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.11 170.19 7.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.173 -0.955 . . . . 0.0 109.591 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' B' ' 31' ' ' GLU . 15.5 mt -107.63 148.84 28.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 21' ' ' GLU . 1.9 ptpt -124.74 85.47 2.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.692 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.501 ' HG2' ' N ' ' B' ' 30' ' ' SER . 24.5 ttmt 59.66 -86.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.371 -0.831 . . . . 0.0 110.231 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.501 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 10.1 m -42.97 -56.37 3.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 0.0 110.184 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.3 mp0 -47.49 -42.15 22.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.057 -1.027 . . . . 0.0 109.538 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.641 HD21 ' HB2' ' B' ' 27' ' ' LEU . 26.6 mt -55.39 -61.79 2.11 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.598 -0.689 . . . . 0.0 109.476 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.756 ' HE2' HG11 ' B' ' 53' ' ' VAL . 6.0 ttmt -47.89 -70.19 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.272 -0.893 . . . . 0.0 109.705 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.476 ' OE2' ' HA ' ' B' ' 31' ' ' GLU . 18.8 pt-20 -44.07 -28.76 0.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.16 -0.962 . . . . 0.0 109.463 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 1.0 HD22 ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -58.75 -57.74 11.66 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.848 . . . . 0.0 109.479 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.888 HG23 HD22 ' B' ' 40' ' ' LEU . 2.6 mp -74.07 -55.11 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.687 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.422 ' C ' ' O ' ' B' ' 36' ' ' ILE . 4.9 m120 -41.75 -27.6 0.12 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.308 -0.87 . . . . 0.0 109.771 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.524 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 3.1 m-20 -90.79 -45.65 8.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.189 -0.944 . . . . 0.0 109.549 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CG1' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -73.25 -65.65 0.78 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.165 -0.959 . . . . 0.0 109.511 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.888 HD22 HG23 ' B' ' 36' ' ' ILE . 8.5 mp -62.88 -49.71 73.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.257 -0.902 . . . . 0.0 109.48 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.203 -0.936 . . . . 0.0 109.376 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.753 HG21 ' HB ' ' B' ' 53' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' B' ' 49' ' ' GLU . 2.8 ptpt -43.41 -26.89 0.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.853 . . . . 0.0 109.528 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.517 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.1 tt0 178.36 -32.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.449 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.53 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 1.2 mt-30 165.09 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.287 -0.883 . . . . 0.0 109.451 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -70.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.18 -0.95 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.905 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -90.18 -24.37 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.206 -0.934 . . . . 0.0 109.238 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.756 HG11 ' HE2' ' B' ' 33' ' ' LYS . 40.0 t -75.97 -29.86 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.219 -0.926 . . . . 0.0 108.885 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.53 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 6.8 t0 -79.82 -39.67 30.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.326 -0.859 . . . . 0.0 108.895 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.543 ' O ' HG23 ' B' ' 59' ' ' THR . 44.3 mmtt -65.54 -51.93 56.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 109.029 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.88 HG22 ' O ' ' B' ' 52' ' ' VAL . 16.5 m -55.8 -45.93 79.73 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 O-C-N 121.287 -0.883 . . . . 0.0 109.641 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.644 ' HE1' ' HA2' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -39.01 -31.66 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.809 -1.182 . . . . 0.0 110.224 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.465 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.1 OUTLIER -90.63 -35.98 14.66 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.142 -0.974 . . . . 0.0 109.361 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.568 ' OG1' HD23 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -73.15 -60.33 2.29 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.387 -0.82 . . . . 0.0 110.031 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.627 ' CD1' ' CG ' ' B' ' 76' ' ' PHE . 2.9 mt -45.33 -44.21 11.45 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.923 . . . . 0.0 109.61 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 19.9 p-10 -89.95 111.53 22.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 109.494 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -98.34 -23.13 15.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.569 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -82.26 -20.01 38.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.552 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.26 94.21 0.61 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 173.11 -30.62 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.259 -1.142 . . . . 0.0 108.599 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.644 ' HA2' ' HE1' ' B' ' 57' ' ' MET . . . 110.29 21.14 7.08 Favored Glycine 0 N--CA 1.485 1.926 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -107.74 99.72 9.17 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.246 -1.149 . . . . 0.0 109.409 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 17.2 t -72.43 157.4 37.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.191 -0.943 . . . . 0.0 109.698 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 1.1 m-20 -117.17 171.58 7.85 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.619 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -59.05 -50.2 74.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.305 -179.715 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.446 ' CG ' ' HG2' ' A' ' 79' ' ' MET . 18.4 mt-30 -55.81 -45.53 78.28 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.27 -0.894 . . . . 0.0 108.944 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.484 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -76.82 -13.29 60.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.408 -0.807 . . . . 0.0 109.395 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.648 ' HE1' HD21 ' B' ' 35' ' ' LEU . 6.5 t80 -70.72 -66.88 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.191 -0.943 . . . . 0.0 108.607 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.893 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 4.1 mtt -58.59 -39.03 79.24 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.341 -0.849 . . . . 0.0 108.884 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.957 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -64.64 -29.8 70.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.294 -0.879 . . . . 0.0 109.059 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.799 ' CE1' HG11 ' B' ' 56' ' ' VAL . 2.0 t80 -64.45 -63.7 1.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.422 -0.798 . . . . 0.0 109.287 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.726 ' CG2' HD12 ' B' ' 35' ' ' LEU . 49.5 t -56.9 -25.71 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.334 -0.854 . . . . 0.0 109.111 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.833 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -66.11 -41.81 90.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.325 -0.859 . . . . 0.0 109.415 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.0 mtm -73.79 -67.1 0.63 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.261 -0.899 . . . . 0.0 109.41 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.905 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.46 -25.04 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 120.637 -1.289 . . . . 0.0 109.247 -179.576 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.567 HG23 ' CE ' ' A' ' 7' ' ' MET . 13.0 m -76.3 -70.05 0.47 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.154 -0.966 . . . . 0.0 108.963 178.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.6 t -77.13 -49.53 15.03 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.171 -0.956 . . . . 0.0 108.922 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.71 -31.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.757 -0.589 . . . . 0.0 109.774 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.477 ' N ' ' O ' ' B' ' 82' ' ' THR . 47.6 t -87.47 -42.25 12.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.317 -0.864 . . . . 0.0 109.535 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.2 OUTLIER -65.69 -9.96 32.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 109.536 -179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -17.65 64.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.191 -0.943 . . . . 0.0 109.506 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 65.1 t80 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' GLU . 1.3 m . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.635 ' CG ' HG23 ' B' ' 13' ' ' VAL . 0.5 OUTLIER -73.9 -38.89 64.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.077 HD12 HG21 ' B' ' 77' ' ' VAL . 2.9 mm? -80.33 -34.39 36.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.26 -0.9 . . . . 0.0 109.43 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' A' ' 1' ' ' SER . 25.9 tt0 -60.13 -58.34 8.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -63.11 -38.78 92.53 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.22 -0.925 . . . . 0.0 109.254 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -73.22 -11.87 60.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.254 -0.904 . . . . 0.0 109.399 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -42.84 16.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.41 ' C ' HG22 ' A' ' 11' ' ' ILE . 22.0 t -75.53 -25.87 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.405 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.98 -50.01 9.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.224 -0.923 . . . . 0.0 109.514 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.548 HD12 ' CE2' ' A' ' 73' ' ' PHE . 3.9 mm? -62.52 -33.23 74.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.586 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -73.25 -46.33 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.926 . . . . 0.0 109.468 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.586 ' N ' HG23 ' A' ' 11' ' ' ILE . 9.5 t70 -65.83 -16.94 64.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.292 -0.88 . . . . 0.0 109.414 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.951 HG21 HD13 ' B' ' 3' ' ' LEU . 2.8 t -89.99 -37.3 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 0.0 109.359 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 68.7 t80 -62.83 -43.73 98.02 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.02 -1.05 . . . . 0.0 109.456 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 47.8 m170 -82.19 -49.93 9.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.303 -0.873 . . . . 0.0 109.795 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.2 tt0 -52.1 -59.75 4.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 109.612 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.719 ' CG ' HD21 ' A' ' 35' ' ' LEU . 44.7 m-85 -60.57 -48.71 80.59 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.897 . . . . 0.0 109.675 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 60.1 p -63.04 -11.61 20.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.208 -0.932 . . . . 0.0 109.689 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.521 ' HA2' ' CA ' ' A' ' 24' ' ' LYS . . . -70.69 -37.57 67.23 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 9.9 mmt180 -44.13 -41.63 5.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 8.5 tt0 -76.46 82.91 3.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 0.0 109.447 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.13 -91.15 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 21' ' ' GLU . 12.6 p30 -96.59 158.14 15.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' CA ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -89.63 119.91 30.46 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.31 -0.869 . . . . 0.0 109.449 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -169.58 -49.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -0.947 . . . . 0.0 109.693 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 3.6 mtmt -136.48 170.12 16.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 109.71 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD22 ' HB3' ' A' ' 31' ' ' GLU . 24.2 mt -102.43 150.36 23.44 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.292 -0.88 . . . . 0.0 109.463 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.523 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -115.56 70.05 0.74 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.171 -0.956 . . . . 0.0 109.854 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 63.34 -82.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.552 -0.717 . . . . 0.0 110.792 179.215 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.46 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 t -48.99 -29.09 4.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.034 -1.041 . . . . 0.0 110.32 -179.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.64 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.8 mp0 -66.84 -41.89 86.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.95 -1.094 . . . . 0.0 108.794 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.513 ' CD1' ' HE2' ' A' ' 57' ' ' MET . 14.8 mt -59.71 -61.22 2.78 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.78 ' CE ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -40.49 -45.06 2.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.645 -0.66 . . . . 0.0 109.437 179.627 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.414 ' OE1' ' CA ' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -53.09 -61.32 2.38 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 109.319 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.719 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.2 mm? -54.81 -25.6 29.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.266 -0.896 . . . . 0.0 109.929 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.04 HG21 ' CG2' ' A' ' 53' ' ' VAL . 26.6 mm -64.09 -44.79 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.049 -1.032 . . . . 0.0 109.906 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.515 ' ND2' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -82.42 -52.73 6.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.114 -0.991 . . . . 0.0 109.931 -179.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.425 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.8 OUTLIER -40.52 -52.27 2.83 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.39 -0.818 . . . . 0.0 110.248 -179.584 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.909 ' OE2' HG22 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -96.28 -26.12 15.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.058 -1.026 . . . . 0.0 109.949 -179.506 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.798 HD21 ' SD ' ' B' ' 7' ' ' MET . 5.7 mt -135.51 67.46 1.48 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.471 ' HB2' ' CA ' ' A' ' 37' ' ' ASN . 11.4 t . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.863 . . . . 0.0 109.455 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.919 HD13 HG21 ' A' ' 53' ' ' VAL . 6.7 mt . . . . . 0 N--CA 1.495 1.782 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 0.6 OUTLIER 83.49 -43.5 0.1 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.509 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.5 mt-10 168.95 36.61 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.135 -0.978 . . . . 0.0 109.311 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 57.85 36.15 26.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 109.34 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -90.15 -37.38 14.23 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.262 -0.899 . . . . 0.0 109.756 -179.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.897 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.9 t -98.06 -28.42 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.108 -0.995 . . . . 0.0 109.83 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.04 ' CG2' HG21 ' A' ' 36' ' ' ILE . 25.3 t -73.15 -37.35 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.03 -1.044 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -22.32 21.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.143 -0.973 . . . . 0.0 109.281 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 23.8 tttt -84.1 -25.02 30.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.251 -0.906 . . . . 0.0 109.369 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.901 ' CB ' HD21 ' A' ' 60' ' ' LEU . 2.2 m -59.54 -48.26 87.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 O-C-N 121.235 -0.916 . . . . 0.0 109.852 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 15.0 tpp -45.34 -24.62 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.738 -1.226 . . . . 0.0 109.596 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 56' ' ' VAL . 5.7 mm-40 -88.81 -42.14 12.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 109.304 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.1 m -72.44 -62.39 1.46 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.926 . . . . 0.0 109.307 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.901 HD21 ' CB ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.23 44.04 1.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 109.493 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 57' ' ' MET . 15.8 p-10 -77.9 109.98 12.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 109.337 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.523 ' CB ' ' O ' ' A' ' 67' ' ' GLU . 36.8 t30 -49.46 -52.38 29.48 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.163 -0.961 . . . . 0.0 109.44 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -165.49 22.97 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.0 109.997 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.44 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 69.78 94.61 0.06 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.44 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.2 OUTLIER 170.13 -29.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.327 -1.102 . . . . 0.0 108.366 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 110.21 17.11 9.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 62' ' ' ASN . 2.7 pt-20 -113.09 91.2 3.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.27 -1.135 . . . . 0.0 109.109 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.542 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.44 130.89 43.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.681 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.5 m-20 -101.56 170.55 8.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.409 -0.807 . . . . 0.0 108.876 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.411 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.95 -48.69 64.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.033 -1.042 . . . . 0.0 110.457 -179.702 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.51 ' O ' ' CE ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.28 -41.09 65.21 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 109.416 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.587 ' OE1' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -74.53 -23.1 58.76 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 120.929 -1.107 . . . . 0.0 109.062 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.58 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 18.3 t80 -64.07 -52.73 57.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.197 -0.939 . . . . 0.0 108.534 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.872 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.37 -37.85 82.03 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.19 -0.944 . . . . 0.0 108.995 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.529 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -72.73 -19.19 61.43 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.98 . . . . 0.0 108.939 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.882 ' HB2' HD13 ' A' ' 60' ' ' LEU . 9.8 t80 -71.84 -68.31 0.47 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.493 -0.754 . . . . 0.0 109.27 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.909 HG22 ' OE2' ' A' ' 39' ' ' GLU . 39.3 t -66.42 -31.15 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.295 -0.878 . . . . 0.0 109.452 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 74' ' ' MET . . . -59.63 -40.66 88.36 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.282 -0.886 . . . . 0.0 109.384 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.728 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 2.1 mmt -77.76 -71.18 0.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.187 -0.945 . . . . 0.0 109.693 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 1.01 HG11 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.04 -24.39 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.296 -1.502 . . . . 0.0 109.736 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.509 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 13.1 m -77.09 -68.81 0.57 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 108.665 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.34 -49.74 11.11 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.728 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.19 -40.03 0.47 Allowed 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.334 0.588 . . . . 0.0 109.589 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.04 -32.88 16.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.263 -0.898 . . . . 0.0 109.477 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -66.34 -9.95 38.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.889 . . . . 0.0 109.534 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.38 -43.43 40.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.483 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.542 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.289 0.566 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -58.03 -75.74 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 109.66 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.951 HD13 HG21 ' A' ' 13' ' ' VAL . 5.9 mp -76.82 -29.68 56.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.606 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.542 ' HB3' ' CB ' ' B' ' 1' ' ' SER . 41.8 tt0 -58.03 -57.69 11.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.139 -0.976 . . . . 0.0 109.146 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.1 OUTLIER -61.27 -47.04 87.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.323 -0.861 . . . . 0.0 109.166 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.56 ' HB1' ' CB ' ' A' ' 6' ' ' ALA . . . -65.36 -12.68 54.42 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.288 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.876 ' O ' HD12 ' B' ' 11' ' ' ILE . 8.6 ttt -80.81 -44.45 18.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.362 -0.836 . . . . 0.0 109.296 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.38 -44.81 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.898 . . . . 0.0 109.315 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -67.84 -55.85 11.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.291 -0.88 . . . . 0.0 109.306 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.745 HD23 HD13 ' A' ' 3' ' ' LEU . 20.9 mt -45.37 -49.8 12.75 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.249 -0.907 . . . . 0.0 109.237 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.876 HD12 ' O ' ' B' ' 7' ' ' MET . 9.3 mt -60.17 -38.64 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.302 -0.874 . . . . 0.0 109.365 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -57.58 -28.64 63.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.829 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -82.92 -30.82 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.208 -0.933 . . . . 0.0 109.268 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.486 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 22.1 t80 -60.79 -51.1 70.75 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.84 -1.162 . . . . 0.0 109.211 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.458 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -80.16 -37.64 33.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.892 . . . . 0.0 109.615 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.2 tt0 -55.67 -65.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.211 -0.931 . . . . 0.0 109.487 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.581 ' CD2' ' HG ' ' B' ' 35' ' ' LEU . 28.8 m-85 -59.48 -49.73 76.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.552 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.534 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 53.2 p -57.95 -17.27 15.98 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.583 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.94 -37.22 16.53 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CZ ' ' OE1' ' B' ' 34' ' ' GLU . 56.4 mtp85 -46.22 -44.16 15.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -1.137 . . . . 0.0 109.465 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.58 169.97 17.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.432 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -48.37 -54.37 13.16 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.444 ' O ' ' O ' ' B' ' 18' ' ' SER . 73.2 m-20 -70.15 170.96 10.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -1.118 . . . . 0.0 109.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 18' ' ' SER . 1.0 OUTLIER -141.22 70.52 1.35 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.863 . . . . 0.0 109.466 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.486 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -170.01 -36.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.362 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.536 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -121.89 170.19 10.04 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.919 . . . . 0.0 109.382 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.783 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.6 mp -102.21 144.92 30.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.952 . . . . 0.0 109.705 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -97.73 82.11 3.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' CG ' ' B' ' 57' ' ' MET . 0.0 OUTLIER 41.42 -83.87 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.591 -0.693 . . . . 0.0 110.955 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.604 ' N ' ' O ' ' B' ' 28' ' ' LYS . 4.7 t -48.5 -27.38 2.67 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.788 -1.195 . . . . 0.0 109.959 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.783 ' C ' HD23 ' B' ' 27' ' ' LEU . 2.8 mp0 -59.48 -47.01 87.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.894 -1.129 . . . . 0.0 108.38 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.655 HD21 ' CD ' ' B' ' 72' ' ' GLU . 4.1 mt -59.11 -42.99 91.85 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.965 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -45.64 -67.73 0.26 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.517 -0.739 . . . . 0.0 109.722 179.715 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.54 ' CG ' ' O ' ' B' ' 31' ' ' GLU . 12.7 pt-20 -45.49 -44.28 12.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.151 -0.968 . . . . 0.0 109.786 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.829 HD21 ' CG1' ' B' ' 13' ' ' VAL . 3.2 mt -52.28 -45.73 65.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.1 -1.0 . . . . 0.0 109.617 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 1.019 HG23 HD12 ' B' ' 40' ' ' LEU . 11.9 mt -73.14 -23.84 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.258 -0.901 . . . . 0.0 109.853 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.541 ' ND2' ' N ' ' B' ' 37' ' ' ASN . 0.4 OUTLIER -95.18 -1.06 52.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.165 -0.959 . . . . 0.0 109.679 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -109.89 -20.06 12.89 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.159 -0.963 . . . . 0.0 109.285 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.697 ' C ' HD23 ' B' ' 40' ' ' LEU . 10.9 mm-40 -121.44 -22.14 6.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.316 -0.865 . . . . 0.0 109.612 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 1.019 HD12 HG23 ' B' ' 36' ' ' ILE . 4.5 mt -110.5 59.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.219 -0.926 . . . . 0.0 109.535 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 88.4 p . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.29 -0.881 . . . . 0.0 109.555 179.903 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.824 HD12 HG23 ' B' ' 53' ' ' VAL . 2.3 mm . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER -43.34 -38.92 2.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.5 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -163.92 70.15 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.267 -0.896 . . . . 0.0 109.211 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.538 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.5 pt20 41.91 37.48 0.81 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.435 -0.791 . . . . 0.0 109.546 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -65.23 -70.3 0.24 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 109.584 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 2.1 t -86.04 -13.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.125 -0.985 . . . . 0.0 109.439 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.965 HG11 ' CG ' ' B' ' 33' ' ' LYS . 69.0 t -81.03 -29.36 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.0 109.014 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.471 ' HB3' ' O ' ' B' ' 50' ' ' GLN . 33.6 t70 -87.5 -26.1 23.36 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.203 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.2 -40.43 18.13 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 0.0 109.454 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.778 HG22 ' O ' ' B' ' 52' ' ' VAL . 21.0 m -59.83 -45.69 94.56 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 O-C-N 121.205 -0.934 . . . . 0.0 109.606 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -43.06 -27.36 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.969 -1.082 . . . . 0.0 109.258 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' B' ' 56' ' ' VAL . 4.1 mt-10 -83.25 -43.33 16.18 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.302 -0.874 . . . . 0.0 108.793 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.893 HG21 ' SD ' ' B' ' 79' ' ' MET . 38.1 m -75.46 -65.82 0.85 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.694 HD13 ' HB2' ' B' ' 76' ' ' PHE . 5.9 mt -41.03 -55.61 2.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.467 -0.771 . . . . 0.0 109.221 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.05 109.56 20.6 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.263 -0.898 . . . . 0.0 109.521 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.74 3.33 17.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' B' ' 64' ' ' GLY . 3.8 p30 -98.28 -45.83 6.03 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.516 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 102.06 95.13 2.26 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 57.5 t0 177.5 -32.86 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -1.134 . . . . 0.0 108.583 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.25 -21.62 24.1 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.48 ' HB3' ' HE3' ' B' ' 26' ' ' LYS . 26.0 mt-10 -75.82 106.71 7.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -1.134 . . . . 0.0 109.406 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.584 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -69.68 124.03 22.9 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.237 -0.914 . . . . 0.0 109.437 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -92.14 171.0 9.38 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.389 -0.82 . . . . 0.0 109.112 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.411 ' CE2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.43 -50.62 67.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.929 -1.107 . . . . 0.0 109.871 -179.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.455 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -49.21 -29.96 6.36 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.328 -0.857 . . . . 0.0 109.635 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.655 ' CD ' HD21 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -79.13 -34.05 43.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.124 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.989 ' CZ ' HD11 ' A' ' 3' ' ' LEU . 26.8 t80 -61.2 -55.88 27.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.059 -1.026 . . . . 0.0 108.993 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.505 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -62.39 -39.06 92.01 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.385 -0.822 . . . . 0.0 108.818 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -67.75 -18.9 65.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.333 -0.854 . . . . 0.0 108.819 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.853 ' CE2' HG23 ' B' ' 77' ' ' VAL . 0.0 OUTLIER -71.72 -67.46 0.53 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.415 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 1.077 HG21 HD12 ' A' ' 3' ' ' LEU . 41.4 t -56.94 -31.77 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.493 -0.754 . . . . 0.0 109.608 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.872 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -66.55 -38.86 88.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.894 . . . . 0.0 110.147 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.893 ' SD ' HG21 ' B' ' 59' ' ' THR . 9.4 mtp -78.35 -71.52 0.42 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.007 -1.058 . . . . 0.0 109.527 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.655 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -43.36 -25.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.848 0 O-C-N 120.445 -1.409 . . . . 0.0 109.654 -179.562 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.481 ' N ' ' O ' ' B' ' 79' ' ' MET . 8.8 m -78.1 -68.79 0.6 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.963 -1.086 . . . . 0.0 108.612 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.6 t -79.32 -49.96 11.62 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.0 108.628 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.62 -41.2 0.67 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.334 0.588 . . . . 0.0 109.602 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 1.7 t -89.3 -33.48 16.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 0.0 109.551 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' B' ' 81' ' ' THR . 3.2 t-160 -61.28 -15.41 34.92 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.431 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.3 -40.84 64.2 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.242 -0.911 . . . . 0.0 109.469 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 t80 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.488 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 4' ' ' GLU . 57.6 m . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.642 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.1 OUTLIER -58.92 -71.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 109.824 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.065 HD21 HG21 ' B' ' 13' ' ' VAL . 3.2 mm? -73.23 -35.29 66.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.112 -0.992 . . . . 0.0 109.836 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 1' ' ' SER . 19.6 tp10 -55.71 -63.16 1.26 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 109.505 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.51 -47.24 86.49 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -64.49 -11.15 30.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.277 -0.889 . . . . 0.0 109.452 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 60.5 ttp -85.4 -41.24 15.61 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.465 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 11' ' ' ILE . 85.5 t -70.79 -29.79 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.988 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -78.93 -54.72 5.76 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.715 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -55.92 -46.16 78.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.532 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.596 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -59.2 -46.17 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.183 -0.948 . . . . 0.0 109.308 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.596 ' N ' HG23 ' A' ' 11' ' ' ILE . 2.7 t0 -59.01 -22.94 61.47 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.174 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 35' ' ' LEU . 2.3 t -82.79 -27.4 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.189 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 22.4 t80 -69.9 -46.64 64.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.973 -1.079 . . . . 0.0 109.45 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -34.79 49.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.649 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.87 -63.32 1.08 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.248 -0.907 . . . . 0.0 109.597 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.598 ' CD1' HG13 ' A' ' 13' ' ' VAL . 37.5 m-85 -59.14 -51.92 67.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.305 -0.872 . . . . 0.0 109.623 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.48 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 13.9 m -62.41 -12.7 23.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.215 -0.928 . . . . 0.0 109.505 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.489 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -82.83 10.67 56.43 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 -39.4 17.37 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -1.17 . . . . 0.0 109.465 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.499 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 2.6 tt0 -84.15 82.1 8.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 109.467 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.49 -132.93 12.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.475 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 1.7 m-20 -64.03 -91.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -1.142 . . . . 0.0 109.484 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.489 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 176.54 132.33 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.428 ' C ' ' HG3' ' A' ' 26' ' ' LYS . 15.3 p-80 -170.03 -53.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.149 -0.969 . . . . 0.0 109.835 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.541 ' CE ' ' HB3' ' A' ' 67' ' ' GLU . 50.4 mtmt -148.74 170.19 18.76 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.128 -0.982 . . . . 0.0 109.843 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.846 HD23 ' C ' ' A' ' 31' ' ' GLU . 5.2 mp -94.35 152.16 18.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.282 -0.887 . . . . 0.0 109.806 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.499 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -116.65 69.25 0.75 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.111 -0.993 . . . . 0.0 109.324 179.585 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HG3' ' A' ' 57' ' ' MET . 0.0 OUTLIER 62.71 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.625 -0.672 . . . . 0.0 110.639 179.352 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.5 p -50.64 -29.94 12.28 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.7 -1.25 . . . . 0.0 109.799 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.846 ' C ' HD23 ' A' ' 27' ' ' LEU . 9.6 mt-10 -66.2 -42.54 88.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.04 -1.038 . . . . 0.0 108.274 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.928 HD23 ' CE1' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -54.12 -60.74 2.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.083 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.833 ' HD2' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.71 -53.07 4.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.798 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.36 -51.2 11.51 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.238 -0.913 . . . . 0.0 109.705 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.993 HD23 ' HG3' ' A' ' 39' ' ' GLU . 0.3 OUTLIER -57.35 -55.61 32.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.329 -0.857 . . . . 0.0 109.925 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.811 HD13 HG11 ' A' ' 80' ' ' VAL . 68.0 mt -64.61 -9.36 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.188 -0.945 . . . . 0.0 109.966 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 9.2 m120 -91.31 -74.43 0.5 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.076 -1.015 . . . . 0.0 109.563 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -62.02 -12.44 18.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.689 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.993 ' HG3' HD23 ' A' ' 35' ' ' LEU . 6.1 mm-40 -110.83 -44.47 3.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.162 -0.961 . . . . 0.0 109.698 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 1.9 mt -108.4 64.94 0.62 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.128 -0.983 . . . . 0.0 109.472 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.328 -0.857 . . . . 0.0 109.558 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.74 HG21 HG12 ' A' ' 53' ' ' VAL . 2.5 mm . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -67.65 0.23 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.285 -0.885 . . . . 0.0 109.253 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 1.9 tt0 -139.45 42.2 2.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 109.238 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.767 ' HA ' HG12 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 68.62 56.5 0.45 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.311 -0.868 . . . . 0.0 109.34 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -88.64 -70.35 0.65 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -0.933 . . . . 0.0 109.543 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.862 ' O ' HG13 ' A' ' 56' ' ' VAL . 5.4 t -88.0 -23.36 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.13 -0.981 . . . . 0.0 109.289 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.833 HG11 ' HD2' ' A' ' 33' ' ' LYS . 2.8 p -72.5 -32.05 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.012 -1.055 . . . . 0.0 108.731 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.458 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 23.0 t0 -90.37 -37.21 14.15 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.465 -0.772 . . . . 0.0 109.139 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 1.1 ttmt -68.43 -31.82 71.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.335 -0.853 . . . . 0.0 109.427 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.985 ' HB ' HD13 ' A' ' 60' ' ' LEU . 3.7 m -57.99 -49.69 80.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 O-C-N 121.224 -0.923 . . . . 0.0 109.703 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.486 ' HG3' ' HG2' ' A' ' 29' ' ' LYS . 3.0 mmt -43.45 -26.88 0.23 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.807 -1.183 . . . . 0.0 109.496 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -78.37 -45.83 21.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.293 -0.879 . . . . 0.0 108.967 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 15.5 m -86.63 -62.16 1.57 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 109.382 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.985 HD13 ' HB ' ' A' ' 56' ' ' VAL . 4.7 mp -40.1 -28.25 0.05 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.412 -0.805 . . . . 0.0 109.981 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' MET . 8.9 p-10 -48.75 113.21 0.73 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.113 -0.992 . . . . 0.0 109.405 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -78.96 -49.97 11.9 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.209 -0.932 . . . . 0.0 109.503 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.11 -13.79 7.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.225 -0.922 . . . . 0.0 109.822 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 100.26 102.94 2.51 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HB3' ' OE1' ' A' ' 67' ' ' GLU . 0.4 OUTLIER 167.31 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -1.111 . . . . 0.0 108.519 -179.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.56 -20.23 25.33 Favored Glycine 0 N--CA 1.485 1.911 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB3' ' CE ' ' A' ' 26' ' ' LYS . 6.8 mt-10 -69.9 103.28 2.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -1.146 . . . . 0.0 109.133 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.537 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.94 124.11 23.21 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.263 -0.898 . . . . 0.0 109.754 -179.36 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 29.9 t0 -94.21 170.46 9.5 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.552 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.3 OUTLIER -53.96 -51.62 63.29 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 110.214 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -51.48 -34.66 36.63 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.21 -0.931 . . . . 0.0 109.453 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.671 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.13 -27.74 42.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.164 -0.96 . . . . 0.0 109.8 -179.73 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.715 ' CE2' HD23 ' A' ' 10' ' ' LEU . 19.5 t80 -62.47 -49.74 74.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.001 -1.062 . . . . 0.0 108.571 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -63.15 -41.67 99.31 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.51 ' HA ' ' SD ' ' B' ' 74' ' ' MET . . . -72.4 -12.07 60.96 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.928 ' CE1' HD23 ' A' ' 32' ' ' LEU . 6.7 t80 -71.58 -70.05 0.35 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 ' HG ' ' B' ' 3' ' ' LEU . 44.1 t -69.22 -25.46 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.143 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.576 ' CB ' ' HB3' ' B' ' 74' ' ' MET . . . -69.12 -34.49 75.13 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.472 -0.768 . . . . 0.0 109.527 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.722 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -79.12 -70.73 0.48 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.178 -0.951 . . . . 0.0 108.876 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.811 HG11 HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.46 -24.36 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 O-C-N 120.593 -1.317 . . . . 0.0 109.512 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.465 ' N ' ' O ' ' A' ' 79' ' ' MET . 8.2 m -78.56 -69.02 0.59 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 0.0 108.599 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.5 t -79.09 -50.1 11.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.944 . . . . 0.0 108.659 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.46 -40.41 0.56 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.329 0.585 . . . . 0.0 109.619 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.08 -31.97 16.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.516 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -64.64 -11.34 34.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 83' ' ' ALA . 11.8 pt-20 -65.4 -13.71 59.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.231 -0.918 . . . . 0.0 109.466 179.986 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.486 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 14.9 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.988 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -53.54 -60.44 3.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.254 -0.903 . . . . 0.0 109.588 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.971 ' HG ' HG21 ' A' ' 77' ' ' VAL . 3.6 mm? -69.51 -18.36 63.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.22 -0.925 . . . . 0.0 109.54 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' B' ' 1' ' ' SER . 0.6 OUTLIER -64.44 -63.4 1.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.383 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.91 -42.69 94.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.325 -0.859 . . . . 0.0 109.41 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.51 -23.13 67.17 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.237 -0.914 . . . . 0.0 109.509 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.475 ' O ' HG12 ' B' ' 11' ' ' ILE . 2.6 ttp -81.97 -29.75 32.01 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.57 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.43 HG23 ' O ' ' B' ' 4' ' ' GLU . 47.1 t -72.52 -35.81 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.642 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -74.62 -52.23 12.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 109.499 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.98 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -57.33 -45.96 83.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.207 -0.933 . . . . 0.0 109.485 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.856 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 15.1 mm -55.07 -49.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.97 -20.54 66.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 1.065 HG21 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -76.33 -39.06 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 0.0 109.38 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 25.0 t80 -67.87 -46.4 71.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.956 -1.09 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.471 ' O ' ' HB2' ' B' ' 18' ' ' SER . 4.8 m80 -64.92 -54.59 28.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 0.0 109.66 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -56.14 -65.09 0.66 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.206 -0.934 . . . . 0.0 109.501 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.673 ' CZ ' HD12 ' B' ' 35' ' ' LEU . 39.1 m-85 -53.1 -20.39 3.68 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.282 -0.886 . . . . 0.0 109.474 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' B' ' 15' ' ' HIS . 0.5 OUTLIER -71.88 -50.63 27.66 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.722 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' B' ' 23' ' ' ASP . . . -90.5 53.78 3.45 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 15.0 mmm180 -90.2 -46.91 8.13 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -1.167 . . . . 0.0 109.603 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -139.1 81.47 1.84 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.177 -0.952 . . . . 0.0 109.85 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 85.5 -93.0 1.8 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' B' ' 18' ' ' SER . 16.2 m-20 -42.18 150.34 0.13 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.372 -1.075 . . . . 0.0 109.736 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' B' ' 24' ' ' LYS . 1.9 tmmt? -144.12 58.56 1.35 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 33.8 t60 -170.23 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 109.479 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -122.54 169.98 10.46 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 109.38 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.518 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 28.8 mt -119.34 127.81 53.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.947 . . . . 0.0 110.325 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -74.53 153.37 39.1 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.375 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.524 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 16.4 ttmt -36.86 -31.33 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.425 -0.797 . . . . 0.0 109.728 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 28' ' ' LYS . 2.8 t -72.35 -52.36 16.48 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.335 -0.853 . . . . 0.0 109.314 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -49.0 -44.95 41.71 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.115 -0.991 . . . . 0.0 108.553 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.52 HD21 ' CB ' ' B' ' 68' ' ' CYS . 28.7 mt -51.87 -67.13 0.28 Allowed 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.63 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.01 -28.92 0.09 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.416 -0.803 . . . . 0.0 109.789 179.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -70.06 -60.07 2.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.176 -0.952 . . . . 0.0 109.411 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.892 HD21 ' CE1' ' B' ' 73' ' ' PHE . 11.9 tp -45.36 -48.44 13.33 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 0.0 109.654 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.89 HD13 HG11 ' B' ' 80' ' ' VAL . 31.1 mt -66.49 -34.64 71.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.213 -0.929 . . . . 0.0 109.562 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.627 ' ND2' HD11 ' B' ' 47' ' ' ILE . 1.9 m-80 -86.14 7.15 26.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -0.903 . . . . 0.0 109.597 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.512 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 4.4 m-80 -105.21 -46.85 4.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.687 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.526 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 40.6 mp0 -124.9 -10.43 7.19 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.795 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.699 HD21 HG23 ' B' ' 81' ' ' THR . 0.1 OUTLIER -102.47 -4.49 25.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 0.0 109.55 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.971 . . . . 0.0 109.483 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.739 HG22 ' O ' ' B' ' 49' ' ' GLU . 35.0 mm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 36.19 44.68 0.29 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.671 -0.643 . . . . 0.0 109.846 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.739 ' O ' HG22 ' B' ' 47' ' ' ILE . 1.6 pt-20 86.54 -172.47 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.528 ' CG ' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -85.07 63.92 8.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.012 -1.055 . . . . 0.0 109.539 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.422 ' HB3' ' HE2' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -90.64 -70.45 0.68 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.152 -179.731 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.866 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.5 t -88.64 -25.0 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.102 -0.999 . . . . 0.0 109.623 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.63 HG11 ' CG ' ' B' ' 33' ' ' LYS . 2.5 t -72.46 -29.62 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 O-C-N 120.983 -1.073 . . . . 0.0 108.228 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.452 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.79 -42.13 10.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.0 109.123 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -33.56 76.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.349 -0.844 . . . . 0.0 109.589 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.939 ' HB ' HD13 ' B' ' 60' ' ' LEU . 2.9 m -52.55 -55.25 11.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.593 ' H ' HG23 ' B' ' 56' ' ' VAL . 2.5 tpt -40.17 -34.28 0.3 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.072 -1.017 . . . . 0.0 109.692 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.23 -56.83 10.58 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.257 -0.902 . . . . 0.0 108.772 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.719 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.9 m -76.53 -65.5 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.356 -0.84 . . . . 0.0 108.864 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 1.046 HD21 ' CG ' ' B' ' 76' ' ' PHE . 4.6 mp -32.44 -38.1 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.308 0.575 . . . . 0.0 110.258 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 59' ' ' THR . 37.9 t0 -84.92 71.43 10.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.907 . . . . 0.0 109.507 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -86.99 -10.42 53.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 109.429 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.51 -41.64 9.24 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.23 -0.919 . . . . 0.0 109.444 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.74 89.58 1.96 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 175.54 -31.97 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.313 -1.11 . . . . 0.0 108.662 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.09 -32.18 6.89 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 3.6 mm-40 -69.93 126.82 30.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.339 -1.094 . . . . 0.0 109.31 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.575 ' CA ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -78.47 130.57 36.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.087 -1.008 . . . . 0.0 109.561 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -105.26 170.39 7.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.269 -0.894 . . . . 0.0 109.286 179.708 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.856 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 0.9 OUTLIER -49.4 -55.98 11.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.99 -1.069 . . . . 0.0 110.511 -179.742 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.588 ' O ' ' HE3' ' B' ' 74' ' ' MET . 2.3 mt-30 -50.82 -32.63 20.71 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.177 -0.952 . . . . 0.0 109.73 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.887 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -75.78 -32.71 60.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.948 -1.095 . . . . 0.0 109.543 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.98 ' CE2' HD23 ' B' ' 10' ' ' LEU . 3.0 t80 -62.66 -53.58 52.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.174 -0.954 . . . . 0.0 108.91 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.588 ' HE3' ' O ' ' B' ' 71' ' ' GLN . 0.0 OUTLIER -55.28 -46.96 76.15 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.541 -0.725 . . . . 0.0 109.795 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.986 ' HB1' ' CE ' ' B' ' 79' ' ' MET . . . -75.16 -14.28 60.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.075 -1.016 . . . . 0.0 109.195 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 1.046 ' CG ' HD21 ' B' ' 60' ' ' LEU . 1.9 t80 -71.83 -70.24 0.34 Allowed 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.396 -0.815 . . . . 0.0 109.317 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.47 -46.14 93.1 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.589 -0.694 . . . . 0.0 109.609 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.782 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -51.99 -41.41 62.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.439 -0.788 . . . . 0.0 110.551 -179.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.986 ' CE ' ' HB1' ' B' ' 75' ' ' ALA . 12.6 mtm -69.83 -69.68 0.33 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.76 -1.213 . . . . 0.0 109.059 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.89 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -42.49 -23.96 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 120.867 -1.146 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.699 HG23 HD21 ' B' ' 40' ' ' LEU . 0.6 OUTLIER -77.54 -68.77 0.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.832 -1.168 . . . . 0.0 108.899 178.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -78.18 -49.95 12.86 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.138 -0.976 . . . . 0.0 108.367 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.77 -43.25 0.42 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.235 0.54 . . . . 0.0 109.846 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.466 ' SG ' ' HE3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -90.17 -31.94 16.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.532 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -50.99 -34.59 29.68 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.285 -0.885 . . . . 0.0 109.584 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -46.67 -45.89 19.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.241 -0.912 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.553 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.5 tp10 -64.58 -77.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.544 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.758 HD13 HG21 ' B' ' 13' ' ' VAL . 7.2 mp -71.5 -30.17 65.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -56.32 -57.64 11.41 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.0 109.459 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -62.03 -40.15 94.74 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.464 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.639 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -66.45 -17.06 64.58 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.464 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.524 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 36.3 ttp -84.46 -36.19 22.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.891 . . . . 0.0 109.514 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 t -68.03 -42.0 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.948 . . . . 0.0 109.522 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -77.32 -59.78 2.64 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.525 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 85.4 mt -47.77 -48.71 30.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.555 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.75 HD13 ' CZ ' ' A' ' 70' ' ' PHE . 23.6 mm -57.78 -48.14 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 3.1 t0 -62.98 -19.65 64.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.916 . . . . 0.0 109.554 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.827 HG21 ' CD1' ' B' ' 3' ' ' LEU . 2.4 t -80.65 -29.72 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.301 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 18' ' ' SER . 15.1 t80 -73.73 -45.07 54.34 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.003 -1.061 . . . . 0.0 109.295 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.546 ' CE1' ' HD3' ' A' ' 24' ' ' LYS . 4.9 t60 -78.79 -29.36 44.93 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.301 -0.875 . . . . 0.0 109.617 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.6 tt0 -75.8 -62.25 1.65 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.494 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CD1' HG13 ' A' ' 13' ' ' VAL . 27.9 m-85 -55.82 -48.09 76.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 14' ' ' PHE . 1.2 t -67.62 -20.04 65.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.923 . . . . 0.0 109.427 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.469 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -89.75 17.61 51.74 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -88.61 -57.53 2.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -1.166 . . . . 0.0 109.448 -179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -113.53 140.4 48.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.221 -0.924 . . . . 0.0 109.449 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.24 -119.11 4.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.491 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 4.2 m-20 -122.25 -80.67 0.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.224 -1.162 . . . . 0.0 109.463 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.565 ' O ' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER 165.51 99.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.499 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CD2' ' O ' ' A' ' 24' ' ' LYS . 55.1 m-70 -164.24 -41.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.542 ' CD ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -142.35 170.31 15.94 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.241 -0.912 . . . . 0.0 109.446 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.709 HD22 ' HB3' ' A' ' 31' ' ' GLU . 75.1 mt -112.01 134.26 53.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.92 . . . . 0.0 109.823 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 29' ' ' LYS . 3.6 mttt -81.79 165.16 21.14 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 28' ' ' LYS . 11.1 ptpt -45.0 -26.29 0.41 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.11 -0.994 . . . . 0.0 109.141 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 28' ' ' LYS . 4.9 p -82.43 -42.94 17.92 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.3 -0.875 . . . . 0.0 110.039 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HB3' HD22 ' A' ' 27' ' ' LEU . 36.4 mm-40 -56.84 -42.91 80.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.972 -1.08 . . . . 0.0 108.666 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.839 HD21 ' SG ' ' A' ' 68' ' ' CYS . 29.8 mt -62.66 -62.74 1.53 Allowed 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.886 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.62 -28.44 0.07 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.415 -0.803 . . . . 0.0 109.677 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -70.97 -58.36 3.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.441 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.852 HD22 HD21 ' B' ' 3' ' ' LEU . 12.6 mt -51.88 -39.58 59.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.278 -0.888 . . . . 0.0 109.736 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.753 HD12 HG22 ' A' ' 53' ' ' VAL . 0.9 OUTLIER -74.26 -29.17 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.412 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 1.8 m-80 -88.77 -3.14 58.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.93 . . . . 0.0 109.599 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -102.33 -45.91 4.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.188 -0.945 . . . . 0.0 109.512 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.515 ' HG3' ' N ' ' B' ' 4' ' ' GLU . 0.6 OUTLIER -106.14 -18.32 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.721 HD22 ' HB ' ' A' ' 80' ' ' VAL . 0.4 OUTLIER -115.12 72.48 0.8 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.391 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 109.502 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.828 HG13 HG21 ' A' ' 53' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 47' ' ' ILE . 8.9 pttt 173.81 -49.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.97 . . . . 0.0 109.24 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.425 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -131.5 21.19 4.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.371 -0.831 . . . . 0.0 109.062 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mp0 65.48 59.62 0.78 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 0.0 109.32 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.7 -70.36 0.67 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.254 -0.904 . . . . 0.0 109.522 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.785 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.5 t -86.2 -21.13 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.313 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.886 HG11 ' HG3' ' A' ' 33' ' ' LYS . 89.8 t -76.63 -28.37 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.036 . . . . 0.0 109.114 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 28.9 t0 -90.16 -34.88 15.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.289 -0.882 . . . . 0.0 109.448 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -40.81 62.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.216 -0.928 . . . . 0.0 109.692 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.785 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.9 m -62.65 -49.44 83.75 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.075 -1.015 . . . . 0.0 109.622 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.616 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 13.2 tpp -41.98 -25.94 0.08 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.725 -1.234 . . . . 0.0 109.49 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.4 tm-20 -79.72 -50.95 9.84 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.071 -1.018 . . . . 0.0 109.935 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.566 ' CG2' ' N ' ' A' ' 60' ' ' LEU . 2.3 t -77.7 -52.88 8.25 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.899 -1.126 . . . . 0.0 109.782 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.611 HD22 ' HB2' ' A' ' 76' ' ' PHE . 20.4 mt -40.54 -52.67 2.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -71.96 113.28 8.83 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.376 -0.828 . . . . 0.0 109.557 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -110.26 25.73 11.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.335 -0.853 . . . . 0.0 109.38 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.0 -37.01 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.262 -0.898 . . . . 0.0 109.461 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 91.42 73.97 1.27 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.7 OUTLIER -177.39 30.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -1.154 . . . . 0.0 108.471 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.51 63.83 3.82 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.542 ' HB2' ' CD ' ' A' ' 26' ' ' LYS . 3.6 pt-20 -162.96 110.85 1.26 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.326 -1.103 . . . . 0.0 109.298 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.839 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.8 m -69.59 167.58 16.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -127.4 172.11 10.94 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.75 ' CZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.18 -62.13 2.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.648 -1.282 . . . . 0.0 110.352 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.961 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.0 pt20 -48.08 -27.08 2.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.151 -0.968 . . . . 0.0 108.845 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -74.82 -42.8 57.36 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.633 -0.667 . . . . 0.0 109.695 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.786 ' HE1' HD13 ' A' ' 35' ' ' LEU . 32.4 t80 -54.02 -46.85 71.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.317 -0.864 . . . . 0.0 109.611 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 1.075 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 1.6 tpp -63.8 -54.63 32.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 109.336 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.738 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -64.46 -10.62 26.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.241 -0.912 . . . . 0.0 109.534 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.695 ' CE1' HG21 ' A' ' 80' ' ' VAL . 0.2 OUTLIER -74.39 -64.02 1.11 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.664 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.578 ' HB ' ' HE2' ' B' ' 74' ' ' MET . 87.0 t -58.2 -23.8 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.897 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.67 -40.76 88.75 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.525 -0.734 . . . . 0.0 109.19 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.709 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -77.75 -70.95 0.44 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.271 -0.893 . . . . 0.0 109.512 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.721 ' HB ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -44.05 -24.67 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 120.502 -1.374 . . . . 0.0 110.035 -179.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.487 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.2 m -79.64 -66.73 0.84 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.919 -1.113 . . . . 0.0 108.433 178.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.547 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.9 m -78.4 -53.9 6.76 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.88 -44.32 0.49 Allowed 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.259 0.552 . . . . 0.0 109.782 179.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.02 -47.43 65.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.564 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.27 -12.06 26.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.288 -0.883 . . . . 0.0 109.518 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.02 -31.86 17.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.454 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.691 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.19 -70.74 0.11 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.0 109.791 -179.797 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.852 HD21 HD22 ' A' ' 35' ' ' LEU . 7.8 mp -74.64 -37.81 62.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.077 -1.014 . . . . 0.0 109.809 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -52.7 -62.39 1.68 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.952 . . . . 0.0 109.547 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.538 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.0 OUTLIER -60.94 -47.72 85.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.292 -0.88 . . . . 0.0 109.646 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.594 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -60.82 -13.8 17.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.239 -0.913 . . . . 0.0 109.627 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.621 ' O ' HD12 ' B' ' 11' ' ' ILE . 42.6 ttp -83.72 -49.34 9.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.51 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.538 HG12 ' O ' ' B' ' 5' ' ' LYS . 5.8 p -61.6 -34.28 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.285 -0.884 . . . . 0.0 109.648 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.553 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -73.33 -60.25 2.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.538 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.639 HD23 ' CB ' ' A' ' 6' ' ' ALA . 2.0 mm? -44.01 -49.54 8.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.42 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.621 HD12 ' O ' ' B' ' 7' ' ' MET . 13.6 mt -57.53 -47.97 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.233 -0.917 . . . . 0.0 109.548 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -51.34 -27.71 10.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.923 . . . . 0.0 109.474 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.846 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -84.79 -33.18 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.511 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 5.2 t80 -61.2 -49.11 78.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.882 -1.136 . . . . 0.0 109.471 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -78.06 -37.57 46.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.281 -0.887 . . . . 0.0 109.738 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 1.4 tp60 -60.07 -67.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.556 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.555 ' CD1' HG13 ' B' ' 13' ' ' VAL . 53.0 m-85 -57.99 -54.11 50.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 6.4 m -62.82 -12.7 26.28 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.0 109.589 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.88 -21.33 26.12 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.439 ' HB3' ' OE2' ' B' ' 21' ' ' GLU . 5.0 mmt180 -54.95 -47.04 75.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -1.117 . . . . 0.0 109.501 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.439 ' OE2' ' HB3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -168.83 147.98 4.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.491 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.77 -111.24 2.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.448 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -107.98 -78.76 0.58 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.204 -1.174 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER 168.56 -35.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 26.8 m80 -115.95 18.13 15.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.913 . . . . 0.0 109.429 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.489 ' HD2' ' HB2' ' B' ' 67' ' ' GLU . 30.5 mtmt -144.5 152.99 41.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.95 HD21 HD12 ' B' ' 35' ' ' LEU . 3.5 mp -93.59 142.77 26.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.129 -0.982 . . . . 0.0 109.739 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.589 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -98.78 86.29 3.49 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.365 -0.835 . . . . 0.0 109.099 179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 43.39 -86.18 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.43 -0.794 . . . . 0.0 110.826 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.589 ' N ' ' O ' ' B' ' 28' ' ' LYS . 39.1 t -47.82 -33.12 6.87 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.298 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.884 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.1 OUTLIER -56.25 -44.25 79.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.795 -1.19 . . . . 0.0 109.216 -179.784 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.631 HD23 HD22 ' B' ' 27' ' ' LEU . 5.2 mt -65.33 -52.82 51.32 Favored 'General case' 0 C--N 1.297 -1.712 0 O-C-N 121.479 -0.763 . . . . 0.0 109.124 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.82 ' HG2' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.89 -64.27 0.61 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.39 -0.819 . . . . 0.0 109.884 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.544 ' HG3' ' CE2' ' B' ' 17' ' ' TYR . 5.0 pt-20 -47.34 -56.37 6.99 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.128 -0.983 . . . . 0.0 109.69 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.95 HD12 HD21 ' B' ' 27' ' ' LEU . 2.8 mt -43.51 -39.04 3.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.212 -0.93 . . . . 0.0 109.771 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 1.05 HD12 HG22 ' B' ' 53' ' ' VAL . 0.5 OUTLIER -69.46 -52.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.252 -0.905 . . . . 0.0 109.529 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.731 HD21 HG21 ' B' ' 47' ' ' ILE . 40.5 m-80 -89.11 20.79 3.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 109.786 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 1.7 t30 -118.23 -36.12 3.65 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.973 . . . . 0.0 109.491 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 10.1 mm-40 -121.18 -14.27 8.39 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.23 -0.918 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.541 HD11 HG22 ' B' ' 77' ' ' VAL . 1.1 mt -113.25 52.97 0.77 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 -179.986 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.938 HG22 ' H ' ' B' ' 49' ' ' GLU . 26.8 mm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.588 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 88.89 8.25 0.12 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.564 -0.71 . . . . 0.0 109.495 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.938 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.1 tt0 79.68 8.69 1.62 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.47 -0.769 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -176.19 21.25 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.73 -1.231 . . . . 0.0 111.475 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 51.5 tp10 -91.02 -70.74 0.67 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.488 -1.383 . . . . 0.0 109.331 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.775 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.2 t -93.56 -19.38 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.261 -0.899 . . . . 0.0 108.666 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.05 HG22 HD12 ' B' ' 36' ' ' ILE . 4.7 t -78.91 -20.44 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.369 -0.832 . . . . 0.0 109.233 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -85.1 -37.42 20.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.437 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -40.04 30.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 109.422 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' B' ' 52' ' ' VAL . 34.1 m -63.9 -46.07 95.18 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 O-C-N 121.211 -0.931 . . . . 0.0 109.62 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 4.9 tpt -41.87 -27.46 0.12 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.06 -1.025 . . . . 0.0 109.591 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.2 OUTLIER -84.5 -42.84 15.15 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.235 -0.916 . . . . 0.0 108.913 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.451 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.8 m -75.92 -63.99 1.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.353 -0.842 . . . . 0.0 109.753 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.69 HD22 ' HB2' ' B' ' 76' ' ' PHE . 3.8 mt -41.24 -39.43 1.35 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD2' ' HE2' ' B' ' 57' ' ' MET . 50.2 m-20 -90.22 111.87 23.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.283 -0.885 . . . . 0.0 109.431 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' B' ' 72' ' ' GLU . 11.3 p-10 -95.99 -13.59 23.68 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.188 -0.945 . . . . 0.0 109.63 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . 0.409 ' HB3' ' OE2' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -105.73 -22.01 13.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.612 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' B' ' 65' ' ' ASP . . . 80.68 99.82 0.33 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . 0.495 ' CB ' ' O ' ' B' ' 64' ' ' GLY . 0.5 OUTLIER 164.87 -26.16 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.25 -1.147 . . . . 0.0 108.608 -179.787 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . 0.466 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.56 23.44 5.97 Favored Glycine 0 N--CA 1.484 1.874 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' B' ' 67' ' ' GLU . 3.3 pt-20 -110.49 86.27 2.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.366 -1.079 . . . . 0.0 109.316 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 13.1 t -69.9 156.24 39.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.214 -0.929 . . . . 0.0 109.78 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.3 OUTLIER -118.71 171.42 8.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.438 -0.789 . . . . 0.0 108.996 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.45 -51.57 67.92 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.228 -0.92 . . . . 0.0 110.335 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.589 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 16.7 pt20 -57.39 -37.97 73.52 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.411 -0.805 . . . . 0.0 109.222 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.498 ' HG2' ' HG3' ' B' ' 71' ' ' GLN . 1.8 mt-10 -79.3 -15.72 57.51 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.445 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.596 ' CE2' HD12 ' B' ' 10' ' ' LEU . 5.8 t80 -71.05 -63.41 1.11 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 108.708 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.897 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -60.56 -37.78 82.39 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.426 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.844 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -59.58 -37.35 78.29 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.874 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.0 OUTLIER -57.59 -67.39 0.34 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.813 HG23 ' CE2' ' B' ' 76' ' ' PHE . 49.4 t -52.9 -21.95 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 1.075 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -57.42 -58.0 10.18 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.482 -0.761 . . . . 0.0 108.953 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.701 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 27.0 mmm -70.82 -65.56 0.72 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.433 -0.792 . . . . 0.0 109.284 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.874 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -41.5 -25.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.655 -1.278 . . . . 0.0 110.12 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 11' ' ' ILE . 5.3 m -75.75 -70.13 0.45 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.886 -1.134 . . . . 0.0 108.673 178.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -79.11 -49.53 12.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.0 108.327 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.94 -44.0 0.75 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.249 0.547 . . . . 0.0 109.789 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.22 -27.92 19.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.268 -0.895 . . . . 0.0 109.702 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.466 ' HB3' ' HA ' ' B' ' 82' ' ' THR . 81.4 t60 -70.81 -9.34 57.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 109.727 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -9.56 55.88 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.214 -0.929 . . . . 0.0 109.724 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.0 109.808 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.866 ' OE2' HG23 ' B' ' 13' ' ' VAL . 3.7 tt0 -62.03 -71.47 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -0.933 . . . . 0.0 109.493 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.964 HD13 HG21 ' B' ' 13' ' ' VAL . 7.4 mp -71.98 -33.99 68.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.555 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.13 -61.7 2.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.219 -0.926 . . . . 0.0 109.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -61.56 -47.19 86.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.964 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -59.79 -15.28 19.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.279 -0.888 . . . . 0.0 109.375 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.768 ' HE3' HD11 ' B' ' 40' ' ' LEU . 2.9 tpp -82.25 -63.77 1.31 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.213 -0.929 . . . . 0.0 109.539 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.414 ' C ' ' O ' ' A' ' 7' ' ' MET . 19.1 t -44.27 -44.92 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.145 -0.972 . . . . 0.0 109.633 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.687 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -67.15 -60.14 2.86 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.964 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.5 mt -47.66 -70.26 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.212 -0.93 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.695 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 40.5 mt -41.65 -36.95 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.418 -0.801 . . . . 0.0 110.025 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.517 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 2.8 m-20 -60.6 -48.88 79.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.159 -0.963 . . . . 0.0 110.044 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.479 HG21 HD21 ' B' ' 3' ' ' LEU . 1.1 t -62.85 -28.55 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.4 t80 -67.51 -41.97 83.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.9 -1.125 . . . . 0.0 109.601 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -73.43 -34.35 65.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.29 -0.881 . . . . 0.0 110.019 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.517 ' CG ' ' O ' ' A' ' 12' ' ' ASP . 2.1 mt-30 -69.4 -63.31 1.09 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.062 -1.024 . . . . 0.0 109.678 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.783 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 11.5 m-85 -49.88 -44.42 49.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.377 -0.827 . . . . 0.0 109.908 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -65.2 -32.84 74.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.146 -0.971 . . . . 0.0 109.52 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.21 -13.97 30.74 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.535 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 10.0 mtp85 -81.65 -32.84 31.69 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 109.527 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.47 ' OE1' ' HB2' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -79.42 134.01 36.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.286 -0.884 . . . . 0.0 109.434 179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.43 -24.91 1.81 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.47 ' HB2' ' OE1' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -72.11 -46.52 56.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.239 -1.153 . . . . 0.0 109.487 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 18' ' ' SER . 1.2 mttm 66.94 60.33 0.53 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.92 . . . . 0.0 109.43 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.439 ' HB3' ' HD3' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -170.23 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.217 -0.927 . . . . 0.0 109.759 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -142.65 169.93 16.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.158 -0.964 . . . . 0.0 109.783 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.883 HD22 ' HB3' ' A' ' 31' ' ' GLU . 22.0 mt -97.55 163.12 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.29 -0.881 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -126.97 69.95 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.128 -0.983 . . . . 0.0 109.936 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 32' ' ' LEU . 16.5 tptm 63.85 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.468 -0.77 . . . . 0.0 110.695 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.6 p -46.23 -41.42 12.85 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.146 -0.971 . . . . 0.0 110.273 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.883 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -62.28 -39.96 94.68 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.971 -1.08 . . . . 0.0 108.845 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 76' ' ' PHE . 70.0 mt -58.21 -71.05 0.12 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.777 -0.577 . . . . 0.0 109.459 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.706 ' CD ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -43.89 -39.12 3.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.249 -0.907 . . . . 0.0 109.39 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -59.54 4.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.209 -0.932 . . . . 0.0 109.218 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.783 HD12 ' CZ ' ' A' ' 17' ' ' TYR . 13.4 tp -57.23 -55.54 33.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.418 -0.801 . . . . 0.0 109.404 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.916 HD11 ' CE1' ' A' ' 76' ' ' PHE . 2.2 mt -43.65 -29.0 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.36 -0.838 . . . . 0.0 109.254 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 13.7 m120 -82.92 -40.63 19.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.251 -0.906 . . . . 0.0 109.812 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -95.31 21.22 8.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.187 -0.946 . . . . 0.0 109.777 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.985 ' HG3' HD12 ' A' ' 40' ' ' LEU . 22.8 pt-20 -129.52 -45.95 1.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.114 -0.992 . . . . 0.0 109.721 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.985 HD12 ' HG3' ' A' ' 39' ' ' GLU . 3.5 mp -76.67 -17.26 59.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.127 -0.983 . . . . 0.0 109.604 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 1.7 t . . . . . 0 N--CA 1.494 1.741 0 O-C-N 121.443 -0.786 . . . . 0.0 110.724 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.768 HG21 ' HA ' ' A' ' 50' ' ' GLN . 4.0 mt . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -44.69 -26.43 0.38 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.238 -0.914 . . . . 0.0 109.257 179.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER 172.96 49.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.314 -0.866 . . . . 0.0 109.271 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.768 ' HA ' HG21 ' A' ' 47' ' ' ILE . 4.1 mp0 44.15 48.38 7.62 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.23 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -90.12 -53.55 4.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.912 -179.667 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.997 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.0 t -96.05 -20.21 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.129 -0.982 . . . . 0.0 110.041 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.702 HG21 ' CE ' ' A' ' 33' ' ' LYS . 37.1 t -81.5 -30.33 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.772 -1.205 . . . . 0.0 108.698 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -90.01 -24.4 21.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.405 -0.809 . . . . 0.0 108.848 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.8 OUTLIER -82.59 -48.42 11.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.38 -0.825 . . . . 0.0 109.208 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.792 HG21 ' CE1' ' A' ' 76' ' ' PHE . 33.0 m -57.6 -44.77 85.89 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 O-C-N 121.158 -0.964 . . . . 0.0 109.26 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.584 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -37.39 -30.87 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.483 -0.761 . . . . 0.0 109.632 -179.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.36 -44.99 12.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 56' ' ' VAL . 15.8 m -63.9 -65.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.831 HD13 ' CE2' ' A' ' 76' ' ' PHE . 3.3 mt -40.15 -66.76 0.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.444 -0.785 . . . . 0.0 109.602 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.412 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -45.76 94.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.45 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 60' ' ' LEU . 2.1 m-20 -109.62 -5.14 15.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.555 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -100.61 -39.79 7.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.206 -0.934 . . . . 0.0 109.383 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 68.92 0.83 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -168.76 25.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -1.153 . . . . 0.0 108.6 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.412 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 49.11 27.63 7.27 Favored Glycine 0 N--CA 1.482 1.705 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.464 ' OE1' ' HG3' ' A' ' 26' ' ' LYS . 51.0 mm-40 -124.27 133.54 53.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.255 -1.144 . . . . 0.0 109.543 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 15.7 t -78.02 158.95 29.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.275 -0.891 . . . . 0.0 109.614 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.486 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.4 OUTLIER -127.21 171.63 11.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 108.877 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.695 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -58.61 -54.02 51.77 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.293 -0.88 . . . . 0.0 110.488 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.435 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 1.2 pm0 -56.21 -29.71 61.31 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.093 -1.005 . . . . 0.0 108.887 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 6.8 mt-10 -80.13 -25.41 39.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 109.513 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.498 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 8.3 t80 -67.63 -55.65 12.46 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.307 -0.871 . . . . 0.0 108.83 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.539 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 8.9 mtt -61.34 -37.74 84.41 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.526 ' O ' ' CG ' ' A' ' 79' ' ' MET . . . -71.67 -19.9 62.02 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.47 -0.769 . . . . 0.0 109.018 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -72.96 -69.56 0.41 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.792 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.914 HG22 ' CD ' ' A' ' 39' ' ' GLU . 42.0 t -54.61 -38.81 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.241 -0.912 . . . . 0.0 109.647 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.7 ' HB1' ' HB3' ' B' ' 74' ' ' MET . . . -65.76 -29.53 70.05 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.309 -0.869 . . . . 0.0 109.924 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.9 mmm -82.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.045 -1.034 . . . . 0.0 109.57 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.997 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.75 -20.81 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 O-C-N 120.399 -1.438 . . . . 0.0 109.709 -179.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.575 HG23 ' N ' ' A' ' 82' ' ' THR . 4.8 t -87.81 -50.93 6.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.795 -1.191 . . . . 0.0 109.371 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.586 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.2 t -90.32 -51.46 5.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.867 -1.145 . . . . 0.0 107.973 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.45 -37.04 0.08 Allowed 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.275 0.559 . . . . 0.0 109.946 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' A' ' 82' ' ' THR . 3.8 t -90.02 -38.04 13.88 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' A' ' 82' ' ' THR . 28.4 t60 -55.46 -18.33 6.86 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.222 -0.924 . . . . 0.0 109.489 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.54 -41.56 81.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.516 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.0 t80 . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.225 -0.922 . . . . 0.0 109.52 -179.962 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.52 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 8.2 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.423 0.63 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . 0.687 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 1.6 tp10 -60.14 -63.26 1.36 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.838 . . . . 0.0 109.598 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.697 ' CD1' HD23 ' A' ' 10' ' ' LEU . 3.3 mm? -75.88 -34.83 60.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.63 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.52 ' HB2' ' N ' ' B' ' 1' ' ' SER . 2.7 mm-40 -53.45 -61.98 1.95 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.236 -0.915 . . . . 0.0 109.63 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -60.73 -48.06 83.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.23 -0.919 . . . . 0.0 109.546 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -61.11 -14.13 22.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.278 -0.889 . . . . 0.0 109.664 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.545 ' SD ' HG12 ' A' ' 77' ' ' VAL . 1.6 mmt -83.05 -64.37 1.18 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 109.6 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.433 ' H ' HG23 ' B' ' 8' ' ' VAL . 3.2 t -51.35 -25.81 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -75.89 -57.84 3.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.207 -0.933 . . . . 0.0 109.6 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 0.491 HD13 HD11 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -49.26 -39.31 30.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.215 -0.928 . . . . 0.0 109.639 -179.867 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.495 HD12 ' O ' ' B' ' 7' ' ' MET . 4.8 mt -70.46 -35.53 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.209 -0.932 . . . . 0.0 109.665 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 2.6 t70 -69.58 -16.17 63.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 0.0 109.638 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.964 HG21 HD13 ' A' ' 3' ' ' LEU . 1.5 t -89.99 -37.99 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.457 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' SG ' ' B' ' 68' ' ' CYS . 46.1 t80 -66.95 -42.08 85.86 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.866 -1.147 . . . . 0.0 109.341 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . 0.602 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -78.85 -49.79 12.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.497 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 30.1 tt0 -53.98 -59.69 4.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.0 109.504 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.787 ' CG ' HD21 ' B' ' 35' ' ' LEU . 45.5 m-85 -60.43 -47.57 85.55 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.233 -0.917 . . . . 0.0 109.62 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.602 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 97.6 p -61.77 -14.98 37.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.193 -0.942 . . . . 0.0 109.589 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.26 -31.27 66.32 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' B' ' 17' ' ' TYR . 1.4 mtt-85 -77.33 -10.9 59.72 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -1.128 . . . . 0.0 109.404 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -79.66 170.02 17.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.67 -35.51 35.95 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.498 ' CB ' ' HD2' ' B' ' 26' ' ' LYS . 2.5 t0 -75.38 -24.05 57.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -1.119 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 23' ' ' ASP . 6.7 mttp 66.4 25.98 10.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.59 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . 0.533 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -160.69 22.93 0.14 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.558 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.533 ' CE ' ' HB3' ' B' ' 25' ' ' HIS . 0.1 OUTLIER -168.67 169.03 10.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.24 -0.913 . . . . 0.0 109.513 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.803 HD13 ' SG ' ' B' ' 68' ' ' CYS . 7.7 mp -122.36 138.73 54.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.883 . . . . 0.0 109.786 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.537 ' CD ' ' OE2' ' B' ' 31' ' ' GLU . 0.2 OUTLIER -89.77 169.02 11.63 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.028 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.6 mtmt -42.14 -26.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.037 -1.04 . . . . 0.0 109.854 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.451 ' N ' ' O ' ' B' ' 28' ' ' LYS . 36.3 t -77.88 -51.92 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 110.97 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.609 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -58.16 -38.58 76.88 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.76 -1.212 . . . . 0.0 109.026 -179.377 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.957 HD22 ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -58.8 -67.28 0.38 Allowed 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.469 -0.769 . . . . 0.0 108.94 179.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HD3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.08 -30.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.3 OUTLIER -63.75 -64.29 0.93 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.303 179.843 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.787 HD21 ' CG ' ' B' ' 17' ' ' TYR . 4.2 mm? -46.01 -40.32 10.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.33 -0.856 . . . . 0.0 109.65 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.878 HG21 ' CG2' ' B' ' 53' ' ' VAL . 1.7 mp -62.18 -41.82 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.068 -1.02 . . . . 0.0 109.945 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -82.14 -73.81 0.37 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.033 -1.042 . . . . 0.0 111.394 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . 0.426 ' C ' ' ND2' ' B' ' 38' ' ' ASN . 0.1 OUTLIER -68.18 -1.15 5.52 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.032 -1.043 . . . . 0.0 111.465 -178.071 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.562 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -131.03 -9.68 3.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.7 -1.25 . . . . 0.0 110.313 -179.92 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.768 HD11 ' HE3' ' A' ' 7' ' ' MET . 1.6 tp -141.48 78.3 1.63 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.705 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.151 -0.968 . . . . 0.0 109.739 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.702 ' CD1' HG21 ' B' ' 53' ' ' VAL . 2.0 mt . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.472 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER -42.47 -31.85 0.48 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.753 -179.747 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.472 ' CG ' ' O ' ' B' ' 48' ' ' LYS . 0.9 OUTLIER 171.39 65.27 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.216 -0.928 . . . . 0.0 109.405 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 47.97 48.35 18.07 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.931 . . . . 0.0 109.193 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.449 ' OE1' ' HG3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.05 -64.1 1.19 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 1.022 ' CG1' HG13 ' B' ' 80' ' ' VAL . 1.3 t -90.83 -20.9 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.19 -0.944 . . . . 0.0 109.692 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HD3' ' B' ' 33' ' ' LYS . 37.6 t -82.92 -31.35 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 120.803 -1.185 . . . . 0.0 108.993 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.54 -27.67 19.01 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.287 -0.883 . . . . 0.0 109.15 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -86.51 -46.09 10.49 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.333 -0.855 . . . . 0.0 109.447 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 1.134 HG22 HD21 ' B' ' 60' ' ' LEU . 1.2 p -63.52 -41.41 92.56 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.037 -1.04 . . . . 0.0 108.904 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.552 ' CE ' HD13 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.49 -49.25 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.852 -0.53 . . . . 0.0 109.658 179.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -61.7 -44.85 96.14 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.453 ' C ' HD23 ' B' ' 60' ' ' LEU . 34.2 m -65.74 -13.74 59.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.436 -0.79 . . . . 0.0 109.793 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 1.134 HD21 HG22 ' B' ' 56' ' ' VAL . 2.4 mt -87.17 -44.94 11.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.037 -1.039 . . . . 0.0 109.169 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' B' ' 57' ' ' MET . 8.3 m-20 -42.75 112.35 0.35 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.605 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -44.44 -45.58 9.16 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.31 -0.869 . . . . 0.0 109.611 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -155.18 19.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.169 -0.957 . . . . 0.0 109.762 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.13 95.5 2.28 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 t0 179.8 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.275 -1.132 . . . . 0.0 108.442 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 -21.21 28.94 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' B' ' 26' ' ' LYS . 5.3 mm-40 -69.88 108.1 3.84 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.233 -1.157 . . . . 0.0 109.29 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.803 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.4 OUTLIER -69.69 128.1 35.26 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.215 -0.928 . . . . 0.0 109.727 -179.548 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.512 ' N ' ' OE1' ' B' ' 72' ' ' GLU . 9.1 m-20 -100.55 170.3 8.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.27 -0.894 . . . . 0.0 108.649 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.41 ' CD1' HG21 ' A' ' 82' ' ' THR . 0.8 OUTLIER -60.29 -59.37 5.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.757 -1.214 . . . . 0.0 110.148 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.523 ' HA ' ' HG2' ' B' ' 74' ' ' MET . 2.4 mt-30 -52.44 -24.69 8.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.046 -1.034 . . . . 0.0 109.084 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' B' ' 60' ' ' LEU . 0.1 OUTLIER -76.95 -38.15 53.85 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.349 -0.845 . . . . 0.0 109.389 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.549 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 24.7 t80 -68.46 -48.79 63.6 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.197 -0.939 . . . . 0.0 109.092 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.7 ' HB3' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -54.24 -46.48 72.58 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.307 -0.87 . . . . 0.0 109.337 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.505 ' N ' ' SD ' ' B' ' 74' ' ' MET . . . -74.73 -20.1 59.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.165 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.774 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.4 OUTLIER -72.73 -71.11 0.31 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 109.233 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.642 HG21 ' CD2' ' A' ' 3' ' ' LEU . 53.1 t -57.54 -31.29 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.111 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.539 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -59.76 -42.06 92.41 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.338 -0.851 . . . . 0.0 109.227 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.9 mmm -73.63 -70.06 0.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 0.0 109.618 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 1.022 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.32 -25.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 120.891 -1.13 . . . . 0.0 109.591 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.42 ' N ' ' O ' ' B' ' 79' ' ' MET . 11.8 m -70.96 -67.74 0.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.973 -1.079 . . . . 0.0 108.885 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.585 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 0.9 OUTLIER -82.98 -52.95 6.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.057 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.09 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.261 0.553 . . . . 0.0 109.881 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' B' ' 82' ' ' THR . 41.4 t -72.78 -52.69 13.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.565 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -9.91 50.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.266 -0.896 . . . . 0.0 109.583 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -81.85 -20.15 39.55 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.24 -0.912 . . . . 0.0 109.48 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.489 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.508 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 1.013 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 3.0 tt0 -64.32 -50.41 67.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.896 . . . . 0.0 109.468 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.678 HD21 HG11 ' B' ' 13' ' ' VAL . 1.2 mp -79.94 -27.5 39.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.57 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' B' ' 39' ' ' GLU . 37.7 tt0 -60.99 -50.54 72.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 109.525 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -52.88 15.62 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.297 -0.877 . . . . 0.0 109.251 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.747 ' HB1' HD23 ' B' ' 10' ' ' LEU . . . -61.9 -13.26 23.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.926 . . . . 0.0 109.504 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . 0.524 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 42.3 ttp -80.09 -59.08 2.85 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.219 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 75.9 t -57.09 -24.51 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.224 -0.923 . . . . 0.0 109.266 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.11 -51.82 9.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.61 HD23 HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -57.53 -60.66 3.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 109.426 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.669 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 6.9 mt -53.06 -43.97 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.274 -0.891 . . . . 0.0 109.227 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 9.3 m-20 -54.16 -37.18 64.16 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.375 -0.828 . . . . 0.0 109.247 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.821 HG22 ' CE1' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -66.29 -39.77 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.18 -0.95 . . . . 0.0 109.188 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -53.74 -62.85 1.38 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.985 -1.072 . . . . 0.0 108.286 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -66.19 -10.04 37.61 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.291 -0.881 . . . . 0.0 109.13 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 13' ' ' VAL . 1.7 tp60 -67.26 -66.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 109.91 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 1.006 ' CE2' HD22 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -125.05 35.35 4.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.697 -1.252 . . . . 0.0 110.708 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.781 ' OG ' HD21 ' A' ' 27' ' ' LEU . 37.6 m -91.4 -22.36 20.51 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.922 -1.111 . . . . 0.0 109.201 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.507 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -103.36 20.72 41.6 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -60.42 -61.91 2.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -1.132 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -122.87 164.83 17.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.431 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.39 -128.62 11.63 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.565 ' HB2' ' CE1' ' A' ' 25' ' ' HIS . 3.9 m-20 -88.99 -148.81 0.18 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -1.144 . . . . 0.0 109.46 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 14.9 ttpt -145.04 65.81 1.26 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 109.476 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CE1' ' HB2' ' A' ' 23' ' ' ASP . 2.8 p80 -170.33 -34.22 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.227 -0.921 . . . . 0.0 109.969 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.538 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -125.46 170.4 11.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.135 -0.978 . . . . 0.0 110.006 -179.524 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 ' OG ' ' A' ' 18' ' ' SER . 8.1 mt -104.19 170.52 7.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.425 -0.797 . . . . 0.0 109.929 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -133.54 69.89 1.47 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.317 -0.864 . . . . 0.0 109.667 179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 65.21 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.59 -0.694 . . . . 0.0 111.064 179.121 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 m -46.14 -42.32 13.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 110.594 -178.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.832 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.8 mm-40 -59.86 -40.31 88.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.932 -1.105 . . . . 0.0 108.919 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.747 ' CD2' HD13 ' A' ' 60' ' ' LEU . 1.5 mp -55.76 -60.18 3.81 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.637 ' CG ' HG11 ' A' ' 53' ' ' VAL . 9.1 mttt -41.56 -50.97 4.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.237 -0.914 . . . . 0.0 109.93 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 38' ' ' ASN . 0.2 OUTLIER -60.23 -39.42 86.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.998 -1.064 . . . . 0.0 110.126 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.006 HD22 ' CE2' ' A' ' 17' ' ' TYR . 3.8 mm? -52.71 -56.58 14.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.463 -0.773 . . . . 0.0 110.263 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 1.056 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mp -94.29 -57.02 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 120.93 -1.106 . . . . 0.0 109.788 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.95 ' ND2' HD11 ' A' ' 47' ' ' ILE . 1.6 m120 -43.96 -26.19 0.26 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.162 -0.961 . . . . 0.0 109.565 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 34' ' ' GLU . 5.4 t30 -99.82 -41.91 7.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.151 -0.968 . . . . 0.0 109.627 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 58.0 mm-40 -72.05 -62.78 1.31 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.056 HD13 HG23 ' A' ' 36' ' ' ILE . 5.9 mp -41.71 -65.74 0.42 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.394 -0.817 . . . . 0.0 109.57 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.447 179.888 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 1.0 HG13 HG21 ' A' ' 53' ' ' VAL . 45.0 mm . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -42.8 -44.09 4.28 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.417 -0.802 . . . . 0.0 109.342 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.66 ' O ' HG22 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -127.47 153.13 46.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.379 -0.826 . . . . 0.0 109.126 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 1.6 pt20 -85.76 55.55 3.57 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.28 -0.888 . . . . 0.0 109.413 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.52 -45.6 8.84 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 109.954 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.859 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -98.66 -25.78 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.035 . . . . 0.0 110.076 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.0 HG21 HG13 ' A' ' 47' ' ' ILE . 52.0 t -81.92 -24.73 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.812 -1.18 . . . . 0.0 109.354 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -90.23 -37.06 14.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.167 -0.958 . . . . 0.0 108.916 179.247 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -78.26 -47.39 18.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.426 -0.796 . . . . 0.0 109.268 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.687 HG13 HD12 ' A' ' 60' ' ' LEU . 2.9 p -59.12 -44.33 91.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.519 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 10.7 tpt -41.8 -48.76 4.36 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.603 -0.686 . . . . 0.0 109.949 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -57.16 -56.35 22.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.183 -0.948 . . . . 0.0 109.422 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 59' ' ' THR . 7.8 m -66.54 -8.67 28.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.306 -0.871 . . . . 0.0 109.574 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.813 HD22 ' OE1' ' A' ' 72' ' ' GLU . 63.7 mt -96.15 -17.29 20.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 -179.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 62' ' ' ASN . 8.9 m-20 -59.1 113.37 2.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.167 -0.958 . . . . 0.0 109.393 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.424 ' OD1' ' OD2' ' A' ' 69' ' ' ASP . 14.5 t30 -43.5 -47.75 7.25 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 109.535 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -165.84 40.86 0.06 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.41 87.8 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.7 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.311 -1.111 . . . . 0.0 108.632 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 -19.22 27.56 Favored Glycine 0 N--CA 1.485 1.94 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 1.3 mt-10 -71.79 103.2 3.04 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -1.149 . . . . 0.0 109.41 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' CYS . . . . . 0.541 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -70.05 137.02 50.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.303 -0.873 . . . . 0.0 109.258 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 6.5 m-20 -116.85 170.56 8.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.416 -0.803 . . . . 0.0 109.163 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.669 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -52.08 -50.42 61.59 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.056 -1.028 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.562 ' O ' ' HE3' ' A' ' 74' ' ' MET . 0.0 OUTLIER -48.49 -35.73 13.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 109.155 -179.716 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.813 ' OE1' HD22 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.53 -31.84 47.72 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.969 -1.082 . . . . 0.0 109.369 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -53.55 -51.48 62.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.977 -1.077 . . . . 0.0 108.966 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.807 ' HE3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -67.13 -38.36 85.42 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.401 -0.812 . . . . 0.0 109.353 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.807 ' HB2' ' HE3' ' A' ' 74' ' ' MET . . . -68.47 -15.76 63.66 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.081 -1.012 . . . . 0.0 108.866 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.63 ' O ' HG23 ' A' ' 80' ' ' VAL . 1.0 OUTLIER -82.7 -72.29 0.45 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.388 -0.82 . . . . 0.0 109.216 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.567 ' CG2' HD23 ' B' ' 3' ' ' LEU . 54.1 t -54.28 -32.92 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 O-C-N 121.226 -0.921 . . . . 0.0 108.921 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -65.38 -42.02 93.14 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.508 -0.745 . . . . 0.0 109.849 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.721 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 41.6 mmm -77.53 -71.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.914 -1.116 . . . . 0.0 110.089 -179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.859 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -45.07 -23.14 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 O-C-N 120.436 -1.415 . . . . 0.0 109.83 -178.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.612 HG21 HD11 ' B' ' 11' ' ' ILE . 18.5 m -80.77 -66.28 0.9 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.816 -1.178 . . . . 0.0 108.643 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.75 -50.2 10.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 108.596 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.38 -41.51 0.64 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.758 -0.589 . . . . 0.0 109.739 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 16.4 t -63.78 -49.51 72.66 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.262 -0.899 . . . . 0.0 109.598 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.51 -21.67 64.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.522 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -90.04 -21.98 22.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' SER . . . . . 0.409 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -76.34 0.09 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 0.0 109.49 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.61 HD11 HD23 ' A' ' 10' ' ' LEU . 2.8 mp -62.48 -15.75 51.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.918 . . . . 0.0 109.431 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' GLU . . . . . 0.438 ' O ' HG23 ' B' ' 8' ' ' VAL . 1.6 tp10 -73.01 -69.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -58.97 -49.57 77.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 109.322 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' B' ' 7' ' ' MET . . . -54.89 -56.42 19.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.325 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' MET . . . . . 0.523 ' CB ' ' O ' ' B' ' 3' ' ' LEU . 15.5 ttp -43.83 -39.0 3.59 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.385 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 4' ' ' GLU . 87.0 t -61.28 -48.86 87.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.425 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . 1.013 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -62.02 -61.48 2.45 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.565 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' LEU . . . . . 1.006 HD12 ' CZ ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -43.43 -39.12 3.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.312 -0.867 . . . . 0.0 109.489 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.801 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 13.5 mm -61.66 -51.51 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.128 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 6.9 t0 -58.95 -17.06 21.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.321 -0.862 . . . . 0.0 109.229 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.759 HG13 ' CD2' ' B' ' 35' ' ' LEU . 1.3 t -76.5 -53.18 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.286 -0.884 . . . . 0.0 109.166 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.8 t80 -55.1 -50.98 67.84 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.812 -1.18 . . . . 0.0 109.384 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -63.84 1.0 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.166 -0.959 . . . . 0.0 109.93 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.447 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 0.9 OUTLIER -45.31 -68.73 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.806 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.637 ' HE2' HG22 ' B' ' 13' ' ' VAL . 23.4 m-85 -42.73 -34.12 0.86 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.384 -0.822 . . . . 0.0 109.722 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' SER . . . . . 0.536 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -85.69 50.0 1.88 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.19 -0.944 . . . . 0.0 109.294 179.762 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.61 -44.3 1.7 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -23.06 21.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.326 -1.103 . . . . 0.0 109.456 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER -69.84 102.47 1.95 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.213 -0.929 . . . . 0.0 109.504 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . 44.1 -95.84 0.01 OUTLIER Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' B' ' 21' ' ' GLU . 0.4 OUTLIER -112.49 -81.23 0.59 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -1.157 . . . . 0.0 109.411 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' B' ' 18' ' ' SER . 0.1 OUTLIER 175.77 56.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.261 -0.899 . . . . 0.0 109.378 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -136.88 6.63 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.189 -0.944 . . . . 0.0 109.7 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.554 ' O ' HD23 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -170.1 170.53 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.126 -0.984 . . . . 0.0 109.689 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.873 HD13 HD11 ' B' ' 35' ' ' LEU . 26.1 mt -126.54 130.74 51.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.235 -0.915 . . . . 0.0 110.122 -179.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' C ' ' B' ' 29' ' ' LYS . 3.2 ttmt -69.67 154.03 42.57 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.809 ' HA ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.45 -32.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.314 -0.866 . . . . 0.0 109.718 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.8 OUTLIER -76.31 -46.58 27.09 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.322 -0.861 . . . . 0.0 109.481 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.732 ' O ' HD12 ' B' ' 35' ' ' LEU . 0.4 OUTLIER -52.67 -42.96 65.21 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.179 -0.951 . . . . 0.0 108.988 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.825 HD21 ' CB ' ' B' ' 68' ' ' CYS . 5.6 mt -60.3 -66.32 0.54 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.648 -0.657 . . . . 0.0 109.306 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.629 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.6 OUTLIER -42.88 -27.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 109.364 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -66.53 -51.59 54.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -0.873 . . . . 0.0 109.329 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.873 HD11 HD13 ' B' ' 27' ' ' LEU . 2.3 mp -56.77 -42.12 78.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.263 -0.898 . . . . 0.0 109.475 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.546 HG23 ' HB2' ' B' ' 40' ' ' LEU . 3.4 mt -79.91 -14.13 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.268 -0.895 . . . . 0.0 109.563 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' B' ' 33' ' ' LYS . 0.9 OUTLIER -89.38 -14.73 34.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 109.533 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -99.69 -35.43 9.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 0.0 109.507 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.555 ' OE1' HD12 ' B' ' 40' ' ' LEU . 3.2 tm-20 -110.31 -10.01 14.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.505 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' B' ' 81' ' ' THR . 0.3 OUTLIER -131.6 68.08 1.5 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.233 -0.917 . . . . 0.0 109.58 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' ILE . . . . . 0.657 HG21 ' CG2' ' B' ' 53' ' ' VAL . 9.0 mm . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.4 mttt 43.81 32.68 0.62 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.124 -0.985 . . . . 0.0 109.382 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 50.8 tt0 83.14 -43.1 0.11 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.63 -0.668 . . . . 0.0 109.878 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.506 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.8 OUTLIER 176.22 56.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.0 109.645 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -90.55 -69.7 0.71 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -0.932 . . . . 0.0 109.529 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.952 ' CG1' HG13 ' B' ' 80' ' ' VAL . 17.0 t -85.56 -22.22 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.196 -0.94 . . . . 0.0 109.688 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . 0.657 ' CG2' HG21 ' B' ' 47' ' ' ILE . 47.8 t -78.86 -36.02 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.147 -0.97 . . . . 0.0 109.366 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.506 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 23.7 t70 -76.58 -35.66 58.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.252 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -73.53 -45.68 52.22 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.879 . . . . 0.0 109.385 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' VAL . . . . . 1.059 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 25.9 m -59.77 -43.36 91.5 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.147 -0.97 . . . . 0.0 109.69 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . 0.496 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -41.62 -28.11 0.12 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.972 -1.08 . . . . 0.0 109.419 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.6 tm-20 -83.63 -46.25 12.55 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' THR . . . . . 0.477 ' O ' ' C ' ' B' ' 60' ' ' LEU . 7.5 m -68.76 -65.12 0.74 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 109.054 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . 0.644 HD13 ' CD2' ' B' ' 76' ' ' PHE . 21.0 mt -36.44 -62.58 0.45 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.81 -0.556 . . . . 0.0 109.693 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' HA2' ' B' ' 64' ' ' GLY . 5.1 t70 -56.62 98.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.402 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' ASN . . . . . 0.456 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 3.1 m120 -96.33 -11.17 26.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -105.45 -40.67 5.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -0.922 . . . . 0.0 109.479 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . 0.46 ' HA2' ' OD1' ' B' ' 61' ' ' ASP . . . 101.82 95.39 2.26 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 176.71 -32.48 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.211 -1.17 . . . . 0.0 108.61 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 12.82 16.85 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . 0.523 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 20.0 pt-20 -110.39 116.51 31.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.24 -1.153 . . . . 0.0 109.337 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' CYS . . . . . 0.825 ' CB ' HD21 ' B' ' 32' ' ' LEU . 9.0 t -73.04 152.77 41.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.2 -0.937 . . . . 0.0 109.765 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.463 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -115.38 171.8 7.48 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.801 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 1.0 OUTLIER -55.34 -51.46 66.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.123 -0.986 . . . . 0.0 110.305 -179.669 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . 0.476 ' OE1' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -59.98 -36.33 76.93 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.314 -0.867 . . . . 0.0 108.975 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.476 ' HG2' ' OE1' ' B' ' 71' ' ' GLN . 3.4 mt-10 -79.82 -13.12 59.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.091 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 1.006 ' CZ ' HD12 ' B' ' 10' ' ' LEU . 0.0 OUTLIER -73.88 -60.35 2.3 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.654 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . 0.567 ' SD ' ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -67.78 -24.43 65.32 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.524 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -70.14 -30.54 67.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.301 -0.874 . . . . 0.0 108.731 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 1.059 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.8 OUTLIER -75.71 -69.02 0.51 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.226 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD22 ' A' ' 3' ' ' LEU . 42.9 t -49.22 -36.12 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.321 -0.862 . . . . 0.0 109.408 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.54 ' CB ' ' HG2' ' A' ' 74' ' ' MET . . . -66.17 -38.39 87.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.873 . . . . 0.0 110.438 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.73 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 58.5 mtm -78.2 -71.35 0.43 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.888 -1.133 . . . . 0.0 109.795 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' VAL . . . . . 0.952 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -45.41 -23.49 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 O-C-N 120.452 -1.405 . . . . 0.0 109.585 -179.13 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . 0.952 ' HA ' HD21 ' B' ' 40' ' ' LEU . 11.8 m -79.09 -67.27 0.77 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.926 -1.109 . . . . 0.0 108.678 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' THR . . . . . 0.58 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.2 t -80.71 -50.74 9.5 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.206 -0.934 . . . . 0.0 108.615 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.73 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.01 -31.21 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.331 0.586 . . . . 0.0 109.657 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' B' ' 82' ' ' THR . 48.2 t -85.25 -43.59 13.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 0.0 109.516 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' B' ' 82' ' ' THR . 54.4 t-80 -48.07 -33.51 8.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.523 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' B' ' 87' ' ' PHE . 2.0 tt0 -87.97 -28.36 21.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.525 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' B' ' 84' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.445 ' CB ' ' HA ' ' B' ' 39' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.685 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -71.88 -59.92 2.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.446 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 5.9 mp -72.31 -23.96 61.25 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.455 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.44 ' HB3' ' N ' ' A' ' 1' ' ' SER . 10.6 tm-20 -62.77 -61.25 2.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -41.9 94.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.226 -0.921 . . . . 0.0 109.326 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.89 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -66.91 -19.07 65.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.264 -0.898 . . . . 0.0 109.42 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.66 ' O ' HD12 ' A' ' 11' ' ' ILE . 2.2 mtp -76.32 -44.13 38.14 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.246 -0.909 . . . . 0.0 109.401 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 8' ' ' VAL . 3.5 t -65.94 -38.18 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.501 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -75.04 -65.67 0.85 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.481 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.983 HD11 ' HB1' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -43.76 -41.24 4.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.448 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.66 HD12 ' O ' ' A' ' 7' ' ' MET . 61.9 mt -62.19 -45.23 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -56.99 -27.37 61.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.227 -0.921 . . . . 0.0 109.357 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.037 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -80.01 -28.7 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.266 -0.897 . . . . 0.0 109.068 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CZ ' ' O ' ' A' ' 25' ' ' HIS . 34.4 t80 -66.33 -45.69 79.4 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.055 -1.028 . . . . 0.0 109.45 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' OG ' ' A' ' 18' ' ' SER . 8.1 m-70 -80.32 -34.55 36.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.597 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -62.14 -63.38 1.26 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.494 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.501 ' HE1' HG22 ' A' ' 13' ' ' VAL . 43.8 m-85 -59.58 -44.28 93.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.543 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 82.9 p -61.18 -21.09 63.48 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.288 -0.883 . . . . 0.0 109.486 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.482 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -66.73 -31.99 80.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.3 mmt180 -52.51 -41.56 63.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -1.132 . . . . 0.0 109.477 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 23' ' ' ASP . 43.6 tt0 -76.6 81.89 3.26 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.451 ' O ' ' O ' ' A' ' 23' ' ' ASP . . . 43.63 -95.23 0.01 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -57.91 -158.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -1.133 . . . . 0.0 109.448 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 2.8 pttp -153.93 89.79 1.33 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.231 -0.918 . . . . 0.0 109.412 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.564 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -169.05 -36.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.543 ' N ' ' HB2' ' A' ' 18' ' ' SER . 0.0 OUTLIER -122.74 170.11 10.39 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.307 -0.871 . . . . 0.0 109.557 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.872 HD23 ' C ' ' A' ' 31' ' ' GLU . 2.9 mp -110.4 143.65 40.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.274 -0.891 . . . . 0.0 109.503 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 30' ' ' SER . 1.5 tttp -98.56 84.64 3.2 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.301 -0.875 . . . . 0.0 109.282 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' A' ' 30' ' ' SER . 29.1 ttmt 43.17 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.425 -0.797 . . . . 0.0 110.847 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' A' ' 28' ' ' LYS . 2.0 t -47.61 -31.89 4.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.156 -0.965 . . . . 0.0 110.06 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.872 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -58.85 -45.62 89.63 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.832 -1.168 . . . . 0.0 108.64 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.933 HD11 ' SG ' ' A' ' 68' ' ' CYS . 27.1 mt -58.65 -54.95 41.25 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' HG21 ' A' ' 53' ' ' VAL . 1.2 tttt -46.31 -42.46 14.69 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.386 -0.821 . . . . 0.0 109.391 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -58.47 7.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.2 -0.937 . . . . 0.0 109.287 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.037 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.23 -40.25 58.4 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.335 -0.853 . . . . 0.0 109.663 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.628 HD13 HG22 ' A' ' 53' ' ' VAL . 48.0 mt -61.75 -36.33 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.203 -0.936 . . . . 0.0 109.951 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLU . 6.8 m120 -94.92 -71.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.085 -1.01 . . . . 0.0 109.779 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 37' ' ' ASN . 2.6 t-20 -41.53 -27.08 0.08 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.421 -0.799 . . . . 0.0 110.111 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.978 ' HG3' HD23 ' A' ' 35' ' ' LEU . 1.6 mm-40 -112.03 -46.14 3.24 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.09 -1.006 . . . . 0.0 109.726 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.812 ' CG ' HD21 ' A' ' 44' ' ' LEU . 9.3 mp -106.9 61.97 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.103 -0.998 . . . . 0.0 109.582 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.3 p -112.06 13.96 20.72 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.218 -0.926 . . . . 0.0 109.409 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.24 -56.15 1.64 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.44 -43.59 93.82 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.898 . . . . 0.0 109.481 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.812 HD21 ' CG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -116.84 90.89 3.43 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.236 -0.915 . . . . 0.0 109.557 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -85.6 9.66 15.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.249 -0.907 . . . . 0.0 109.453 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.473 ' CD ' ' HG ' ' A' ' 84' ' ' CYS . 4.5 pm0 -67.83 -136.31 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.282 -0.886 . . . . 0.0 109.407 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.578 ' CD1' ' CG2' ' A' ' 36' ' ' ILE . 1.1 mt 64.75 -146.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.968 -1.082 . . . . 0.0 109.213 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.568 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 12.5 mttt 83.59 -44.58 0.11 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.553 -0.717 . . . . 0.0 109.367 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 60.9 mm-40 -110.32 14.69 22.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.238 -0.914 . . . . 0.0 109.03 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.536 ' CB ' ' O ' ' A' ' 49' ' ' GLU . 1.4 mt-30 78.34 59.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.711 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 3.7 mp0 -90.08 -70.6 0.66 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.215 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.837 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.3 t -91.44 -21.18 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.126 -0.984 . . . . 0.0 108.629 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.628 HG22 HD13 ' A' ' 36' ' ' ILE . 55.2 t -73.22 -30.73 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.368 -0.832 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -90.09 -40.42 12.29 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.405 -0.809 . . . . 0.0 109.113 179.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -64.41 -35.5 81.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.326 -0.859 . . . . 0.0 109.272 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.837 HG13 ' O ' ' A' ' 52' ' ' VAL . 4.4 m -55.38 -56.54 11.17 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.263 -0.898 . . . . 0.0 109.716 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.645 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -41.49 -28.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.001 -1.062 . . . . 0.0 109.626 -179.768 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.1 tp10 -69.59 -55.99 8.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.285 -0.884 . . . . 0.0 108.788 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.468 ' O ' ' C ' ' A' ' 60' ' ' LEU . 9.6 m -81.28 -61.68 1.88 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 108.877 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.721 HD13 ' HB ' ' A' ' 56' ' ' VAL . 6.5 mp -37.82 -36.43 0.19 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.695 -0.628 . . . . 0.0 109.79 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 57' ' ' MET . 28.0 t0 -89.98 95.73 10.35 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.213 -0.93 . . . . 0.0 109.433 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -109.69 11.23 24.65 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.248 -0.908 . . . . 0.0 109.498 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -120.97 -30.21 4.44 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.518 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.33 90.77 0.56 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.87 -32.47 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.271 -1.135 . . . . 0.0 108.618 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.2 31.15 Favored Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.471 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 21.9 mt-10 -88.25 107.12 18.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -1.166 . . . . 0.0 109.402 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.933 ' SG ' HD11 ' A' ' 32' ' ' LEU . 4.3 m -69.82 143.58 52.86 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.256 -0.902 . . . . 0.0 109.797 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.515 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.0 m-20 -116.62 169.5 9.3 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.492 ' CZ ' HG12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -51.0 -47.48 61.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.233 -0.917 . . . . 0.0 110.072 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.577 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 16.6 mt-30 -47.92 -42.09 26.28 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.44 -0.787 . . . . 0.0 109.582 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.57 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.03 -25.02 43.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.163 -0.961 . . . . 0.0 109.979 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.457 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 10.4 t80 -59.3 -58.32 9.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.069 -1.019 . . . . 0.0 109.407 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.921 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -68.36 -49.73 58.15 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.233 -0.917 . . . . 0.0 109.46 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB3' ' A' ' 78' ' ' ALA . . . -54.96 -23.47 19.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.117 -0.99 . . . . 0.0 108.973 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.815 ' CE1' HG21 ' A' ' 80' ' ' VAL . 2.2 t80 -70.3 -63.67 1.04 Allowed 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HG23 ' A' ' 80' ' ' VAL . 3.3 t -52.91 -23.57 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.959 ' HB2' ' HB3' ' B' ' 74' ' ' MET . . . -62.33 -54.23 43.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.421 -0.799 . . . . 0.0 108.865 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 1.4 mmm -70.52 -69.44 0.36 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.379 -0.825 . . . . 0.0 109.479 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.815 HG21 ' CE1' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -41.03 -25.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 120.567 -1.333 . . . . 0.0 110.129 -179.416 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.2 m -76.36 -69.98 0.47 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.919 -1.113 . . . . 0.0 108.512 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.572 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.6 t -78.04 -49.91 13.09 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.95 -47.75 1.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 44' ' ' LEU . 9.2 t -61.27 -47.12 87.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.471 -0.768 . . . . 0.0 109.286 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -68.34 -9.93 51.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.25 -0.906 . . . . 0.0 109.488 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 87' ' ' PHE . 0.8 OUTLIER -82.68 -21.06 35.05 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.313 -0.867 . . . . 0.0 109.498 -179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -44.08 -26.53 0.3 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.25 -0.906 . . . . 0.0 109.486 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.403 ' N ' ' O ' ' A' ' 86' ' ' GLU . 18.6 m-85 -74.37 -54.11 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.459 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -93.65 131.36 39.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.5 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -138.7 112.55 8.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 109.437 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.478 -179.967 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.532 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 3' ' ' LEU . 1.3 tp10 -70.38 -55.35 9.29 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.719 HD21 HG11 ' A' ' 13' ' ' VAL . 3.1 mm? -75.44 -27.64 59.02 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.27 -0.894 . . . . 0.0 109.39 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.532 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 2.8 tm-20 -67.15 -61.55 1.87 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.82 -49.3 71.37 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.92 . . . . 0.0 109.41 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.983 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -65.02 -22.59 67.02 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.289 -0.882 . . . . 0.0 109.453 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.48 ' HG2' HD12 ' B' ' 11' ' ' ILE . 5.3 ttt -68.95 -42.61 76.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.427 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 76.8 t -70.34 -34.16 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.217 -0.927 . . . . 0.0 109.433 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.685 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -65.73 -64.46 0.86 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.243 -0.911 . . . . 0.0 109.472 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.804 HD22 ' SD ' ' B' ' 74' ' ' MET . 0.4 OUTLIER -50.74 -47.94 59.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.473 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 88.7 mt -56.42 -36.0 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.179 -0.951 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 0.7 OUTLIER -67.6 -29.85 69.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.244 -0.91 . . . . 0.0 109.439 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 1.072 HG13 HD11 ' B' ' 35' ' ' LEU . 10.8 t -75.72 -25.02 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.4 t80 -74.69 -50.95 15.66 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.996 -1.065 . . . . 0.0 109.478 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.446 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 15.6 m80 -78.28 -20.82 50.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.25 -0.906 . . . . 0.0 109.832 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 53.3 tt0 -83.13 -60.29 2.2 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.139 -0.976 . . . . 0.0 109.565 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.648 ' CD2' HD13 ' B' ' 35' ' ' LEU . 28.0 m-85 -63.32 -28.18 69.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.889 . . . . 0.0 109.541 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' B' ' 25' ' ' HIS . 84.6 p -71.09 -20.48 62.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.189 -0.945 . . . . 0.0 109.69 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.96 30.28 10.71 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.14 -59.49 2.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -1.144 . . . . 0.0 109.529 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 22' ' ' GLY . 0.2 OUTLIER -114.74 97.54 6.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.9 . . . . 0.0 109.513 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 49.78 -179.85 0.02 OUTLIER Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' B' ' 22' ' ' GLY . 81.0 m-20 52.06 174.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -1.162 . . . . 0.0 109.452 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -172.44 59.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.24 -0.912 . . . . 0.0 109.511 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.523 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -169.2 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.275 -0.891 . . . . 0.0 109.542 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.488 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 1.4 mptt -122.97 160.75 25.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.274 -0.891 . . . . 0.0 109.54 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.763 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.8 mp -109.27 132.29 54.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.928 . . . . 0.0 109.584 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -79.73 170.12 16.98 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -45.82 -25.01 0.45 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.879 -1.138 . . . . 0.0 109.324 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.509 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 0.2 OUTLIER -82.28 -50.54 8.84 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.646 -179.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.763 ' C ' HD23 ' B' ' 27' ' ' LEU . 43.0 mt-10 -56.68 -38.65 72.53 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.893 -1.13 . . . . 0.0 109.402 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.873 HD22 HD23 ' B' ' 60' ' ' LEU . 16.0 mt -65.02 -57.44 8.68 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.594 -0.691 . . . . 0.0 109.293 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 1.13 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -42.27 -50.29 4.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.339 -0.851 . . . . 0.0 109.497 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' B' ' 35' ' ' LEU . 0.0 OUTLIER -51.58 -61.62 2.13 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.188 -0.945 . . . . 0.0 109.151 179.736 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 1.072 HD11 HG13 ' B' ' 13' ' ' VAL . 1.1 tp -43.47 -38.1 2.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.311 -0.868 . . . . 0.0 109.43 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 1.045 HG13 HG22 ' B' ' 53' ' ' VAL . 3.0 mm -57.18 -49.93 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.229 -0.919 . . . . 0.0 109.586 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.448 ' O ' ' N ' ' B' ' 39' ' ' GLU . 51.1 m-80 -93.01 -65.35 1.0 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 109.807 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' B' ' 37' ' ' ASN . 0.6 OUTLIER -41.14 -26.92 0.06 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.412 -0.805 . . . . 0.0 110.265 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 3.9 mm-40 -118.73 -40.54 2.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.987 -1.071 . . . . 0.0 109.986 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.97 ' HB3' HD13 ' B' ' 44' ' ' LEU . 5.3 mp -108.14 67.11 0.66 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.094 -1.004 . . . . 0.0 109.596 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 28.1 t -107.84 26.56 10.18 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 109.417 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.81 -77.28 0.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.917 . . . . 0.0 109.502 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -85.52 -8.44 58.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.897 . . . . 0.0 109.554 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.97 HD13 ' HB3' ' B' ' 40' ' ' LEU . 3.1 mp -105.9 -12.36 15.87 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.198 -0.938 . . . . 0.0 109.473 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 48.75 -150.97 0.15 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.239 -0.913 . . . . 0.0 109.443 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' B' ' 47' ' ' ILE . 55.0 mm-40 -86.32 58.68 5.19 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 109.397 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.72 HD12 ' CG2' ' B' ' 53' ' ' VAL . 10.5 mm 57.26 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.31 -0.869 . . . . 0.0 109.437 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.501 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.1 mmtp -111.28 55.33 0.66 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.501 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 3.0 tp10 74.31 41.79 0.36 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.261 -0.9 . . . . 0.0 109.353 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.455 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.1 OUTLIER 72.51 51.48 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.304 -0.872 . . . . 0.0 109.447 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' B' ' 48' ' ' LYS . 24.7 tt0 -88.65 -70.16 0.66 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.492 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 1.4 t -87.47 -21.21 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.349 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.13 HG11 ' CD ' ' B' ' 33' ' ' LYS . 77.0 t -73.54 -26.06 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.207 -0.933 . . . . 0.0 109.27 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -85.16 -47.95 9.62 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.211 -0.931 . . . . 0.0 109.438 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 14.0 mttt -62.58 -41.9 99.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.213 -0.929 . . . . 0.0 109.395 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.917 ' HB ' HD13 ' B' ' 60' ' ' LEU . 31.1 m -59.28 -49.34 83.81 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 O-C-N 121.196 -0.94 . . . . 0.0 109.474 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -44.5 -26.38 0.35 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.977 -1.077 . . . . 0.0 109.453 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 55' ' ' LYS . 0.8 OUTLIER -77.08 -45.79 25.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.224 -0.922 . . . . 0.0 108.994 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.443 ' O ' ' C ' ' B' ' 60' ' ' LEU . 66.5 m -84.31 -63.81 1.27 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.312 -0.867 . . . . 0.0 109.371 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.917 HD13 ' HB ' ' B' ' 56' ' ' VAL . 9.1 mp -41.73 -27.86 0.12 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.585 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' B' ' 57' ' ' MET . 3.6 m-20 -63.55 114.68 4.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.256 -0.903 . . . . 0.0 109.333 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' B' ' 67' ' ' GLU . 2.6 t-20 -42.77 -44.31 4.34 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.386 -0.821 . . . . 0.0 109.623 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.73 28.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.245 -0.909 . . . . 0.0 109.566 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.3 90.87 1.18 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' B' ' 65' ' ' ASP . 43.5 t0 -179.34 -34.44 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.312 -1.11 . . . . 0.0 108.581 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.479 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.12 38.65 1.64 Allowed Glycine 0 N--CA 1.485 1.912 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' B' ' 62' ' ' ASN . 15.2 pt-20 -141.09 105.74 4.9 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.205 -1.174 . . . . 0.0 109.469 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.488 ' N ' ' HB3' ' B' ' 26' ' ' LYS . 12.2 t -78.59 153.4 31.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.256 -0.902 . . . . 0.0 109.748 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.495 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -110.13 171.16 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 179.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.56 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -61.27 -48.95 79.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.155 -0.965 . . . . 0.0 109.973 -179.804 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.582 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 9.4 mp0 -54.84 -40.19 69.35 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 108.953 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.2 mt-10 -78.83 -18.47 53.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.407 -0.808 . . . . 0.0 109.527 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.763 ' CZ ' HD23 ' B' ' 10' ' ' LEU . 3.5 t80 -67.25 -62.14 1.57 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.181 -0.949 . . . . 0.0 109.046 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.959 ' HB3' ' HB2' ' A' ' 78' ' ' ALA . 1.8 tpp -63.51 -48.04 79.23 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.108 -0.995 . . . . 0.0 108.978 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.684 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -51.54 -36.47 45.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.161 -0.962 . . . . 0.0 108.622 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.757 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.2 OUTLIER -57.86 -62.95 1.44 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.235 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.605 HG21 HD21 ' B' ' 10' ' ' LEU . 3.5 t -49.74 -27.9 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.921 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -58.4 -54.56 45.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.387 -0.821 . . . . 0.0 109.093 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 54.7 mtm -71.47 -68.84 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.365 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.757 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -40.6 -26.48 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 120.602 -1.311 . . . . 0.0 110.036 -179.637 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.517 ' N ' ' O ' ' B' ' 79' ' ' MET . 3.7 m -75.11 -70.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.993 -1.067 . . . . 0.0 108.7 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.7 t -78.08 -49.63 13.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.124 -0.985 . . . . 0.0 108.455 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.78 -44.22 0.72 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.752 -0.592 . . . . 0.0 109.71 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.408 ' O ' ' HB3' ' B' ' 87' ' ' PHE . 0.5 OUTLIER -89.37 -28.86 19.5 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.571 -179.928 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.453 ' HB2' ' O ' ' B' ' 81' ' ' THR . 0.8 OUTLIER -65.54 -70.06 0.26 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -43.95 -28.32 0.45 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.505 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' B' ' 88' ' ' PHE . 11.2 t80 -44.99 -54.04 7.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.202 -0.936 . . . . 0.0 109.417 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.502 ' O ' ' N ' ' B' ' 90' ' ' HIS . 89.3 t80 -43.99 -45.75 7.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' B' ' 86' ' ' GLU . 0.7 OUTLIER -44.18 96.13 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.248 -0.907 . . . . 0.0 109.463 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.502 ' N ' ' O ' ' B' ' 88' ' ' PHE . 0.2 OUTLIER -94.13 147.24 23.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.273 -0.892 . . . . 0.0 109.467 179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.456 -179.986 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.544 ' HB2' ' CB ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.805 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.5 OUTLIER -68.28 -79.45 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.821 HD11 HG11 ' B' ' 13' ' ' VAL . 4.9 mp -68.13 -23.04 64.85 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.164 -0.96 . . . . 0.0 109.421 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.544 ' CB ' ' HB2' ' A' ' 1' ' ' SER . 0.2 OUTLIER -63.3 -60.84 2.86 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.23 -0.918 . . . . 0.0 109.229 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 1' ' ' SER . 4.1 tttt -60.73 -29.58 69.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.342 -0.848 . . . . 0.0 109.182 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -71.42 -26.72 62.87 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.34 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.474 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.9 ttm -75.62 -38.71 58.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.332 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.84 -39.49 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.313 -0.867 . . . . 0.0 109.433 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.815 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -72.85 -62.93 1.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 109.508 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.675 ' CD2' HD23 ' B' ' 3' ' ' LEU . 48.7 mt -44.12 -43.69 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.385 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.474 HD12 ' O ' ' A' ' 7' ' ' MET . 62.3 mt -56.75 -53.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.5 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -54.51 -22.78 13.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.942 ' CG1' HD11 ' A' ' 35' ' ' LEU . 4.2 t -82.58 -33.7 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.29 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.547 ' CZ ' ' N ' ' A' ' 70' ' ' PHE . 9.9 t80 -63.12 -47.46 82.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.055 -1.028 . . . . 0.0 109.523 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -80.72 -46.33 15.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 109.712 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -54.52 -62.45 1.65 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 109.669 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.599 ' CD1' HG13 ' A' ' 13' ' ' VAL . 30.2 m-85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.657 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 26.2 m -60.16 -21.43 61.65 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.158 -0.964 . . . . 0.0 109.617 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.66 30.28 10.75 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' CG ' ' HA ' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.01 -50.78 5.82 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -1.17 . . . . 0.0 109.511 179.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . 81.3 mt-10 -134.72 83.99 2.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.258 -0.901 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.82 -170.81 54.94 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.422 ' O ' ' HD2' ' A' ' 24' ' ' LYS . 88.7 m-20 47.75 -169.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.313 -1.11 . . . . 0.0 109.502 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' C ' ' HB3' ' A' ' 18' ' ' SER . 0.3 OUTLIER -169.31 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.491 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -108.08 16.15 23.61 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.251 -0.906 . . . . 0.0 109.44 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -151.14 170.14 20.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.209 -0.932 . . . . 0.0 109.452 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.8 HD23 ' C ' ' A' ' 31' ' ' GLU . 3.0 mp -108.46 141.22 40.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.88 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.607 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.8 OUTLIER -91.15 79.19 5.77 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 109.079 179.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.586 ' CG ' ' CG ' ' A' ' 57' ' ' MET . 0.0 OUTLIER 41.53 -83.03 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.578 -0.701 . . . . 0.0 111.17 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.607 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -49.24 -27.43 3.73 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.669 -1.269 . . . . 0.0 109.711 -179.77 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.8 ' C ' HD23 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -60.31 -46.19 90.75 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.916 -1.115 . . . . 0.0 108.617 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.706 ' N ' HD23 ' A' ' 27' ' ' LEU . 7.0 mt -59.75 -51.76 68.39 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 1.007 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -46.36 -36.53 6.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 109.338 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -53.49 43.89 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.592 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.942 HD11 ' CG1' ' A' ' 13' ' ' VAL . 4.7 mt -50.72 -52.52 39.63 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.713 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.027 HG23 HD12 ' A' ' 40' ' ' LEU . 1.9 mp -66.51 -24.59 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.262 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -90.98 -3.72 57.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.222 -0.924 . . . . 0.0 109.615 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -114.05 -14.42 12.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.239 -0.913 . . . . 0.0 109.496 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.742 ' OE1' HD22 ' B' ' 3' ' ' LEU . 5.9 pt-20 -120.94 -14.93 8.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.483 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.117 HD22 HD21 ' A' ' 44' ' ' LEU . 23.8 mt -120.2 75.12 1.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -135.88 68.12 1.46 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.477 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -51.31 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.496 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.23 -77.1 0.55 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.21 -0.931 . . . . 0.0 109.393 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.117 HD21 HD22 ' A' ' 40' ' ' LEU . 2.4 pp -68.4 112.94 5.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.335 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -125.81 2.75 7.42 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.212 -0.93 . . . . 0.0 109.709 -179.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.571 ' OE2' ' CG ' ' A' ' 87' ' ' PHE . 6.1 tt0 -44.42 -37.16 3.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.146 -0.971 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.911 ' CD1' HG21 ' A' ' 36' ' ' ILE . 43.4 mt -63.24 -83.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 109.485 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 7.4 pttm 40.24 28.48 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.636 -0.665 . . . . 0.0 109.877 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.492 ' H ' HG22 ' A' ' 47' ' ' ILE . 5.8 tt0 170.56 -78.83 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.303 -0.873 . . . . 0.0 109.3 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.517 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 14.1 pt20 -168.04 26.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.302 -0.874 . . . . 0.0 109.518 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.25 -69.28 0.3 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.234 -0.916 . . . . 0.0 109.413 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.769 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.6 t -86.67 -21.13 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 109.342 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.007 HG11 ' HG3' ' A' ' 33' ' ' LYS . 41.3 t -77.02 -19.29 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.286 -0.884 . . . . 0.0 109.762 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' A' ' 50' ' ' GLN . 53.9 t0 -90.06 -36.5 14.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.181 -0.949 . . . . 0.0 109.598 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -79.74 -38.01 34.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 109.579 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 52' ' ' VAL . 30.8 m -60.43 -43.74 94.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.193 -0.942 . . . . 0.0 109.773 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.586 ' CG ' ' CG ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -39.78 -29.08 0.05 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.078 -1.014 . . . . 0.0 109.488 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.495 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -87.04 -42.56 12.99 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.908 HG21 ' CE ' ' A' ' 79' ' ' MET . 98.9 m -70.03 -64.92 0.8 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.79 . . . . 0.0 109.587 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.64 ' CD1' ' CD2' ' A' ' 76' ' ' PHE . 7.3 mt -38.4 -60.43 0.79 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.474 -0.766 . . . . 0.0 109.589 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.41 112.26 6.57 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.271 -0.893 . . . . 0.0 109.534 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -120.02 16.67 12.5 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.415 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.24 -47.87 2.91 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 92.17 2.18 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -177.89 -35.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.285 -1.126 . . . . 0.0 108.567 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.12 22.83 6.66 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HB2' ' HE2' ' A' ' 26' ' ' LYS . 19.5 pt-20 -128.44 118.54 23.28 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -1.119 . . . . 0.0 109.437 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.523 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.82 132.51 46.17 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.25 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 1.2 p30 -104.59 169.62 8.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.301 -0.874 . . . . 0.0 108.97 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.547 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -50.19 -47.99 54.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.059 -1.026 . . . . 0.0 110.105 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 75' ' ' ALA . 14.1 pt20 -52.48 -37.5 57.35 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.432 -0.793 . . . . 0.0 109.672 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.524 ' OE2' ' CD2' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -82.38 -20.5 37.04 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.065 -1.022 . . . . 0.0 109.775 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 1.6 t80 -66.66 -64.27 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.133 -0.979 . . . . 0.0 109.061 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.867 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.9 -32.82 71.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.384 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.663 ' HA ' ' HB2' ' B' ' 75' ' ' ALA . . . -65.33 -31.71 72.98 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.263 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.736 ' CZ ' HG21 ' A' ' 56' ' ' VAL . 1.1 t80 -70.44 -59.22 2.98 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.293 -0.879 . . . . 0.0 108.976 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.447 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.4 t -56.57 -25.39 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.989 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.67 -49.2 71.9 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.383 -0.823 . . . . 0.0 109.369 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.908 ' CE ' HG21 ' A' ' 59' ' ' THR . 2.3 mtm -71.94 -70.76 0.31 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.333 -0.855 . . . . 0.0 109.682 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.8 HG11 HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -41.91 -25.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 O-C-N 120.623 -1.298 . . . . 0.0 110.242 -179.187 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.606 HG21 ' HE1' ' B' ' 74' ' ' MET . 3.8 m -74.91 -68.03 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.875 -1.141 . . . . 0.0 108.589 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.8 m -81.68 -51.48 8.15 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.07 -40.64 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.206 0.527 . . . . 0.0 109.913 179.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.486 ' SG ' ' CB ' ' A' ' 46' ' ' GLU . 12.0 t -79.02 -40.89 30.22 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.605 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.2 OUTLIER -64.98 -11.89 43.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.139 -0.975 . . . . 0.0 109.477 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.451 ' OE2' HG23 ' A' ' 82' ' ' THR . 0.5 OUTLIER -90.31 -36.0 14.93 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.571 ' CG ' ' OE2' ' A' ' 46' ' ' GLU . 2.9 m-85 -43.86 -27.06 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.308 -0.87 . . . . 0.0 109.535 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -66.25 -50.81 62.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.272 -0.893 . . . . 0.0 109.376 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.99 172.94 15.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.277 -0.89 . . . . 0.0 109.465 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' O ' ' OXT' ' A' ' 91' ' ' GLU . 26.0 m-70 -81.24 172.97 12.98 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.525 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.422 ' O ' ' OE1' ' A' ' 91' ' ' GLU . 1.9 tm-20 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.472 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.815 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 6.4 mm-40 -71.22 -63.47 1.1 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.248 -0.907 . . . . 0.0 109.386 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.76 HD11 ' CD2' ' A' ' 35' ' ' LEU . 0.6 OUTLIER -70.18 -25.32 63.38 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.43 -65.6 0.67 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.317 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.426 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.1 OUTLIER -62.97 -37.06 85.58 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.273 -0.892 . . . . 0.0 109.25 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.782 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -68.71 -17.23 64.03 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.396 -0.815 . . . . 0.0 109.411 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.25 -39.86 20.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.503 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.456 ' O ' HG22 ' B' ' 11' ' ' ILE . 2.4 p -68.97 -31.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.17 -0.956 . . . . 0.0 109.449 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -83.3 -50.42 8.4 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.562 HD12 ' O ' ' B' ' 6' ' ' ALA . 5.4 mt -57.75 -34.71 69.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.794 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -73.26 -47.61 46.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.15 -0.969 . . . . 0.0 109.402 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.576 ' N ' HG23 ' B' ' 11' ' ' ILE . 65.8 t0 -57.34 -19.96 25.83 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.124 -0.985 . . . . 0.0 108.894 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.869 HG22 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -88.14 -41.94 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.37 -0.831 . . . . 0.0 109.632 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.473 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 34.2 t80 -53.93 -42.89 69.3 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.887 -1.133 . . . . 0.0 109.041 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.417 ' O ' ' C ' ' B' ' 16' ' ' GLN . 8.3 t-160 -77.58 -38.65 47.88 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.346 -0.846 . . . . 0.0 109.281 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' B' ' 15' ' ' HIS . 0.9 OUTLIER -44.03 -48.61 8.83 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 108.958 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.869 ' CE2' HG22 ' B' ' 13' ' ' VAL . 12.7 m-85 -92.47 -70.27 0.7 Allowed 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.403 -0.811 . . . . 0.0 109.107 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 4.1 p 38.87 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.594 -0.691 . . . . 0.0 109.99 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 17' ' ' TYR . . . 88.12 44.19 5.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.428 ' C ' ' O ' ' B' ' 19' ' ' GLY . 0.1 OUTLIER -42.49 -27.42 0.16 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.428 -1.042 . . . . 0.0 109.625 -179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.434 ' O ' ' HE2' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -100.05 69.91 1.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.03 -115.51 2.34 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' B' ' 19' ' ' GLY . 70.6 m-20 -61.85 148.61 42.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -1.17 . . . . 0.0 109.551 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.472 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.9 tttt -119.29 34.6 5.15 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.258 -0.901 . . . . 0.0 109.512 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.536 ' HB2' ' CE ' ' B' ' 26' ' ' LYS . 33.9 m170 -136.98 8.84 3.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.536 ' CE ' ' HB2' ' B' ' 25' ' ' HIS . 0.3 OUTLIER -169.95 156.24 6.03 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.713 ' CD1' HD12 ' B' ' 35' ' ' LEU . 9.8 mt -85.08 147.5 26.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.573 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -125.63 85.75 2.44 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.839 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.633 ' HA ' HD12 ' B' ' 32' ' ' LEU . 12.6 tppt? 60.97 -86.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.361 -0.837 . . . . 0.0 110.211 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.508 ' N ' ' HG3' ' B' ' 29' ' ' LYS . 7.2 m -44.04 -52.49 7.07 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.172 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' B' ' 27' ' ' LEU . 0.3 OUTLIER -55.91 -38.42 70.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.12 -0.987 . . . . 0.0 109.469 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 29' ' ' LYS . 36.7 mt -61.25 -70.17 0.2 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.579 -0.701 . . . . 0.0 109.291 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.1 OUTLIER -44.85 -24.61 0.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.687 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.446 ' OE1' ' O ' ' B' ' 30' ' ' SER . 0.1 OUTLIER -71.52 -69.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.134 -0.979 . . . . 0.0 109.537 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.811 HD21 ' CG1' ' B' ' 13' ' ' VAL . 2.4 mt -43.99 -47.91 8.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.305 -0.872 . . . . 0.0 109.732 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.767 ' CG2' HG11 ' B' ' 80' ' ' VAL . 11.6 mm -60.93 -43.07 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.656 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.459 ' HA ' ' HB3' ' B' ' 41' ' ' SER . 13.5 m-80 -90.18 8.38 33.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' B' ' 34' ' ' GLU . 2.1 t30 -94.0 -46.25 7.23 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.199 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.541 ' OE1' HD13 ' A' ' 3' ' ' LEU . 3.8 mp0 -124.64 -9.9 7.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.266 -0.896 . . . . 0.0 109.601 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.872 ' HB3' HD21 ' B' ' 44' ' ' LEU . 5.2 mp -112.93 37.38 3.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.203 -0.935 . . . . 0.0 109.496 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' B' ' 37' ' ' ASN . 2.9 p -115.13 10.7 16.16 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.185 -0.947 . . . . 0.0 109.489 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -115.52 -28.8 6.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.209 -0.932 . . . . 0.0 109.474 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -97.57 -72.48 0.64 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.208 -0.933 . . . . 0.0 109.524 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.872 HD21 ' HB3' ' B' ' 40' ' ' LEU . 0.5 OUTLIER -68.58 105.0 2.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.194 -0.942 . . . . 0.0 109.415 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 1.5 pt-20 -98.34 16.4 21.68 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.259 -0.901 . . . . 0.0 109.566 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.45 ' HB2' ' SG ' ' B' ' 84' ' ' CYS . 0.5 OUTLIER -76.14 -49.26 17.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.184 -0.947 . . . . 0.0 109.387 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.962 HD11 ' CG1' ' B' ' 80' ' ' VAL . 43.7 mt -48.83 -92.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.872 . . . . 0.0 109.396 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.512 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.0 mtmt 43.54 27.02 0.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.251 -0.906 . . . . 0.0 109.516 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 170.85 -75.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.409 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' HB ' ' B' ' 53' ' ' VAL . 0.5 OUTLIER -169.62 27.46 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.218 -0.926 . . . . 0.0 109.553 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.79 -70.24 0.27 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.217 -0.927 . . . . 0.0 109.303 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.979 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.0 t -87.76 -14.72 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.195 -0.941 . . . . 0.0 109.258 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.759 HG23 HD13 ' B' ' 47' ' ' ILE . 43.1 t -77.73 -19.16 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.116 -0.99 . . . . 0.0 109.249 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -90.09 -37.18 14.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.227 -0.921 . . . . 0.0 109.284 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -47.5 20.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.309 -0.869 . . . . 0.0 109.352 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.925 HG11 HG22 ' B' ' 80' ' ' VAL . 31.1 m -55.3 -46.2 78.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.229 -0.919 . . . . 0.0 109.63 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.16 -47.47 6.23 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.204 -0.935 . . . . 0.0 109.887 -179.675 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.17 -56.42 21.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 109.824 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.998 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.7 t -67.64 -9.43 43.18 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.201 -0.937 . . . . 0.0 109.803 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.83 HD21 ' CD2' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -97.95 -11.47 23.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.876 . . . . 0.0 109.52 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.438 ' OD2' ' SD ' ' B' ' 57' ' ' MET . 48.9 m-20 -83.47 114.78 21.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.355 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -101.24 -17.31 16.65 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.935 . . . . 0.0 109.67 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -141.06 8.97 2.1 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.157 -0.965 . . . . 0.0 109.741 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 71.79 94.48 0.08 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 1.0 OUTLIER 169.22 -28.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.333 -1.098 . . . . 0.0 108.45 -179.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.48 -5.69 29.84 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.639 -1.385 . . . . 0.0 109.639 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.512 ' HB3' ' CD ' ' B' ' 26' ' ' LYS . 1.8 mm-40 -69.91 110.34 4.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -1.147 . . . . 0.0 109.219 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 14.3 t -87.89 156.49 19.34 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.179 -0.951 . . . . 0.0 109.675 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.452 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.6 OUTLIER -116.33 170.9 8.19 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.584 ' CZ ' HG12 ' B' ' 11' ' ' ILE . 1.2 t80 -57.73 -51.58 68.97 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.197 -0.94 . . . . 0.0 110.167 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.75 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 4.0 pt20 -53.81 -44.05 69.87 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.466 -0.771 . . . . 0.0 109.3 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' B' ' 76' ' ' PHE . 3.3 mt-10 -74.05 -19.37 60.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.328 -0.857 . . . . 0.0 109.617 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.537 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 12.6 t80 -65.7 -63.1 1.17 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.244 -0.91 . . . . 0.0 109.178 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.989 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 0.5 OUTLIER -58.65 -46.07 87.93 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.196 -0.94 . . . . 0.0 108.743 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' HA ' ' A' ' 75' ' ' ALA . . . -58.44 -26.53 63.43 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.221 -0.924 . . . . 0.0 108.525 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.83 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.0 OUTLIER -64.17 -69.26 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.732 HG13 HD11 ' B' ' 40' ' ' LEU . 39.3 t -51.68 -23.65 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.437 -0.789 . . . . 0.0 109.122 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.867 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -63.95 -45.58 88.51 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.289 -0.882 . . . . 0.0 109.304 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.998 ' SD ' HG21 ' B' ' 59' ' ' THR . 42.7 mtm -78.03 -64.35 1.18 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.89 . . . . 0.0 109.677 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.979 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.89 -23.04 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 O-C-N 120.481 -1.387 . . . . 0.0 109.526 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.603 ' OG1' HD21 ' B' ' 40' ' ' LEU . 4.8 m -78.85 -67.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.04 -1.037 . . . . 0.0 109.113 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.2 t -77.1 -49.3 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.063 -1.023 . . . . 0.0 109.037 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.649 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.92 -39.86 0.25 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.747 -0.595 . . . . 0.0 109.966 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' B' ' 44' ' ' LEU . 29.6 t -67.55 -49.38 63.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.242 -0.911 . . . . 0.0 109.554 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.41 -9.93 51.73 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.564 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 87' ' ' PHE . 1.6 tm-20 -89.9 -23.65 21.56 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.229 -0.919 . . . . 0.0 109.525 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.424 ' C ' ' O ' ' B' ' 86' ' ' GLU . 3.4 t80 -44.15 -44.93 8.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -90.0 -20.37 23.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.895 . . . . 0.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 55.83 -173.2 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.258 -0.901 . . . . 0.0 109.476 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 121.48 24.23 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.468 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 1.2 m . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.615 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.3 OUTLIER -62.1 -39.2 91.66 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.257 -0.902 . . . . 0.0 109.612 -179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.782 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.2 mm? -80.56 -28.52 37.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.24 -0.912 . . . . 0.0 109.551 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 8.8 tp10 -64.9 -58.64 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mmtt -65.79 -37.75 87.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.253 -0.904 . . . . 0.0 109.581 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.479 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -67.59 -18.45 64.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.617 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.527 ' HG2' HD12 ' A' ' 11' ' ' ILE . 14.4 ttp -82.6 -49.68 9.59 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.928 . . . . 0.0 109.561 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.95 -27.71 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' B' ' 2' ' ' GLU . . . -78.29 -65.63 0.95 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.576 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.66 HD13 ' HG3' ' A' ' 74' ' ' MET . 19.9 mt -49.76 -46.13 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.585 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.527 HD12 ' HG2' ' A' ' 7' ' ' MET . 50.8 mt -58.88 -44.86 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.523 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 26.4 t0 -62.59 -21.42 65.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.935 HG11 HD21 ' B' ' 3' ' ' LEU . 2.8 t -85.25 -26.0 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.2 -0.938 . . . . 0.0 109.425 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 2.9 t80 -72.43 -52.08 17.49 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.974 -1.078 . . . . 0.0 109.285 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.545 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 0.3 OUTLIER -74.48 -30.31 61.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.885 . . . . 0.0 109.635 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 25.3 tt0 -72.4 -63.32 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.22 -0.925 . . . . 0.0 109.603 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.527 ' HA ' ' CD ' ' A' ' 20' ' ' ARG . 11.2 m-85 -56.44 -28.86 60.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.251 -0.905 . . . . 0.0 109.411 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.545 ' HG ' ' HA ' ' A' ' 15' ' ' HIS . 60.8 p -77.59 -31.0 52.73 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.498 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.51 -22.56 63.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 17.3 mtp85 -69.04 -27.6 65.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -1.144 . . . . 0.0 109.453 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.521 ' CG ' ' N ' ' A' ' 22' ' ' GLY . 46.8 tt0 -97.91 165.74 11.78 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.252 -0.905 . . . . 0.0 109.393 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.521 ' N ' ' CG ' ' A' ' 21' ' ' GLU . . . -43.93 -63.01 2.42 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.01 -177.68 0.28 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.284 -1.127 . . . . 0.0 109.463 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 15' ' ' HIS . 28.8 mtmt -143.69 45.56 1.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.253 -0.905 . . . . 0.0 109.469 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.437 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t60 -164.91 25.7 0.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.29 -0.881 . . . . 0.0 109.455 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.745 ' C ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -170.03 170.21 7.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.264 -0.898 . . . . 0.0 109.486 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 26' ' ' LYS . 9.7 mp -120.49 164.69 16.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.487 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -122.59 69.65 0.98 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.235 -0.916 . . . . 0.0 109.504 179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.668 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER 63.05 -83.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.618 -0.676 . . . . 0.0 110.686 179.441 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -46.68 -35.4 5.99 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.146 -0.971 . . . . 0.0 110.86 -178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.597 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.7 mp0 -62.64 -42.3 99.52 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 108.851 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.703 HD22 ' CD2' ' A' ' 60' ' ' LEU . 5.1 mt -57.6 -56.62 19.6 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.633 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.5 -45.35 4.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.426 -0.796 . . . . 0.0 109.431 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.422 ' HG2' ' NH2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -63.86 -42.39 97.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.346 -0.846 . . . . 0.0 109.616 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.596 HD21 HG13 ' A' ' 13' ' ' VAL . 18.6 mt -48.18 -60.25 2.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.26 -0.9 . . . . 0.0 109.799 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.842 ' CG2' HD11 ' A' ' 44' ' ' LEU . 1.8 mp -75.55 -16.9 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.308 -0.87 . . . . 0.0 109.729 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.509 HD21 HD11 ' A' ' 47' ' ' ILE . 1.8 m-80 -93.62 1.09 56.75 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.188 -0.945 . . . . 0.0 109.709 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 34' ' ' GLU . 14.7 t30 -117.1 -25.39 7.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.138 -0.977 . . . . 0.0 109.295 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.597 ' HB2' HD12 ' B' ' 3' ' ' LEU . 68.8 mm-40 -126.58 -10.14 6.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.901 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.825 ' HB3' HD21 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -120.08 56.61 0.96 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.042 -1.036 . . . . 0.0 109.489 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 45' ' ' GLU . 63.7 p -112.97 11.23 19.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.301 -0.874 . . . . 0.0 109.385 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -104.27 -39.23 6.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 109.422 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.62 ' CE1' ' NE2' ' A' ' 85' ' ' HIS . 1.7 m-85 -88.49 -66.05 0.96 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.256 -0.902 . . . . 0.0 109.46 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.842 HD11 ' CG2' ' A' ' 36' ' ' ILE . 0.3 OUTLIER -80.94 6.35 13.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.886 . . . . 0.0 109.518 179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' A' ' 41' ' ' SER . 3.5 mp0 51.14 -91.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.211 -0.931 . . . . 0.0 109.574 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 44' ' ' LEU . 22.6 pt-20 -135.83 177.39 7.87 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.438 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.73 HG13 HG21 ' A' ' 53' ' ' VAL . 8.2 mm -81.15 135.62 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.476 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.6 mttt -86.27 61.82 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.252 -0.905 . . . . 0.0 109.251 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.5 OUTLIER 83.29 -42.49 0.1 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.663 -0.648 . . . . 0.0 109.647 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.49 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 2.1 mt-30 167.43 57.95 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.093 -1.004 . . . . 0.0 109.341 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 2.0 tt0 -89.29 -70.34 0.66 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.157 -0.964 . . . . 0.0 109.587 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.788 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.1 t -90.54 -20.74 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.113 -0.992 . . . . 0.0 109.238 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.73 HG21 HG13 ' A' ' 47' ' ' ILE . 24.9 t -77.22 -29.11 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.156 -0.965 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 0.5 OUTLIER -90.12 -32.41 16.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.38 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 1.1 tmtp? -75.88 -37.76 58.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.407 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 1.013 ' HB ' HD13 ' A' ' 60' ' ' LEU . 8.8 m -56.35 -53.2 42.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.211 -0.93 . . . . 0.0 109.748 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.592 ' H ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -40.16 -28.91 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.155 -0.966 . . . . 0.0 109.53 -179.713 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.5 OUTLIER -75.03 -50.54 16.18 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.468 HG21 ' SD ' ' A' ' 79' ' ' MET . 14.3 m -79.19 -64.8 1.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 108.794 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.108 HD21 ' CG ' ' A' ' 76' ' ' PHE . 4.2 mp -38.09 -47.82 1.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.708 -0.62 . . . . 0.0 109.756 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 57' ' ' MET . 0.5 OUTLIER -88.3 86.9 7.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.54 -7.64 7.46 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -0.923 . . . . 0.0 109.513 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -78.27 -41.7 33.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.488 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.46 2.12 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -177.28 -35.41 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.244 -1.151 . . . . 0.0 108.593 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.35 -13.38 36.51 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.485 ' CB ' ' HD2' ' A' ' 26' ' ' LYS . 8.5 mt-10 -108.67 147.38 31.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -1.13 . . . . 0.0 109.515 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.52 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 1.9 t -69.79 147.74 50.04 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.307 -0.87 . . . . 0.0 109.601 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 0.3 OUTLIER -116.63 170.98 8.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.513 -0.742 . . . . 0.0 109.359 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -61.45 -52.05 66.16 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.346 -0.847 . . . . 0.0 110.453 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -51.94 -39.32 59.04 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.327 -0.858 . . . . 0.0 109.548 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.52 ' CG ' ' SG ' ' A' ' 68' ' ' CYS . 1.6 pt-20 -79.6 -22.58 43.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.157 -0.965 . . . . 0.0 109.637 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.411 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 10.8 t80 -62.28 -59.53 4.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 109.003 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.845 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 2.4 ttm -65.22 -44.8 87.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.314 -0.867 . . . . 0.0 109.1 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.24 -22.17 62.71 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.009 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 1.108 ' CG ' HD21 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.48 -63.59 1.09 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.815 . . . . 0.0 108.838 179.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.705 HG13 HD11 ' A' ' 40' ' ' LEU . 42.0 t -56.52 -23.1 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -63.48 -49.97 71.49 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.499 -0.751 . . . . 0.0 109.065 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.696 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 39.1 mtp -72.77 -70.11 0.37 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.388 -0.82 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.715 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -41.25 -25.84 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 120.575 -1.328 . . . . 0.0 110.02 -179.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 1.018 HG21 HD11 ' B' ' 11' ' ' ILE . 4.6 m -77.67 -69.96 0.51 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.936 -1.102 . . . . 0.0 108.629 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -77.8 -49.91 13.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.093 -1.004 . . . . 0.0 108.325 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.25 -48.21 1.77 Allowed 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 121.371 0.605 . . . . 0.0 109.453 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 44' ' ' LEU . 13.4 t -61.03 -46.3 91.3 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.317 -0.864 . . . . 0.0 109.403 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.62 ' NE2' ' CE1' ' A' ' 43' ' ' PHE . 3.4 m-70 -68.43 -11.19 59.34 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.456 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' A' ' 87' ' ' PHE . 4.8 tp10 -86.99 -37.26 17.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.4 ' C ' ' O ' ' A' ' 86' ' ' GLU . 49.2 t80 -44.98 -26.21 0.4 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 109.395 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -68.09 0.5 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.21 167.5 21.79 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.238 -0.914 . . . . 0.0 109.42 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -139.64 131.46 27.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.219 -0.926 . . . . 0.0 109.436 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.456 179.966 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.553 ' HB3' ' N ' ' B' ' 5' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.487 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 2.5 mp0 39.23 -93.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.577 -0.702 . . . . 0.0 110.249 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.935 HD21 HG11 ' A' ' 13' ' ' VAL . 20.5 mt -75.83 -50.41 15.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.932 . . . . 0.0 109.43 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' B' ' 1' ' ' SER . 0.9 OUTLIER -49.87 -34.54 20.43 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.176 -0.952 . . . . 0.0 109.023 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.553 ' N ' ' HB3' ' B' ' 1' ' ' SER . 0.5 OUTLIER -69.87 -51.77 30.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.256 179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.493 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -66.15 -10.0 36.91 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 109.339 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.734 ' O ' HD12 ' B' ' 11' ' ' ILE . 4.0 mtp -80.5 -57.71 3.46 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.267 -0.895 . . . . 0.0 109.392 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' B' ' 12' ' ' ASP . 16.5 t -64.23 -32.71 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.3 -0.875 . . . . 0.0 109.351 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.615 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -70.19 -68.9 0.39 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.333 -0.854 . . . . 0.0 109.561 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 1.048 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -51.3 -60.39 3.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.255 -0.903 . . . . 0.0 109.493 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 81' ' ' THR . 28.2 mt -42.86 -41.06 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -59.12 -47.92 83.49 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.364 -0.835 . . . . 0.0 109.659 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.946 HG22 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -61.23 -34.05 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.137 -0.977 . . . . 0.0 109.673 -179.616 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.59 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 9.1 t80 -60.11 -70.32 0.17 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.045 -1.034 . . . . 0.0 109.159 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -64.79 -9.82 23.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.723 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.501 ' HB3' ' HA ' ' B' ' 13' ' ' VAL . 56.7 tp60 -75.49 -69.93 0.45 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.834 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 1.169 ' CE2' HD23 ' B' ' 35' ' ' LEU . 0.0 OUTLIER -100.26 21.37 13.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.145 -0.972 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.602 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.5 t -80.86 -19.9 43.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 109.328 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.508 ' CA ' ' HA ' ' B' ' 24' ' ' LYS . . . -103.1 8.71 53.94 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.471 ' HG2' ' CA ' ' B' ' 17' ' ' TYR . 22.1 mmt180 -52.89 -54.28 36.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -1.177 . . . . 0.0 109.449 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' CE ' ' B' ' 28' ' ' LYS . 1.0 OUTLIER -127.91 103.55 7.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.57 -147.48 16.42 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.47 ' O ' ' HA2' ' B' ' 19' ' ' GLY . 0.2 OUTLIER -71.41 167.28 19.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.249 -1.147 . . . . 0.0 109.474 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.508 ' HA ' ' CA ' ' B' ' 19' ' ' GLY . 3.5 mttp -104.93 40.85 1.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.924 . . . . 0.0 109.496 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -134.17 11.39 3.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.226 -0.921 . . . . 0.0 109.437 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB2' ' B' ' 67' ' ' GLU . 0.5 OUTLIER -161.71 169.99 20.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.458 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.804 HD13 ' OH ' ' B' ' 17' ' ' TYR . 59.1 mt -120.61 141.01 50.73 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.707 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.52 ' CE ' ' O ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -87.25 165.72 15.46 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.489 ' N ' ' HD3' ' B' ' 29' ' ' LYS . 6.8 mmtp -42.72 -31.86 0.52 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.267 -0.896 . . . . 0.0 109.011 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 30.6 p -73.5 -58.0 3.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.443 -0.786 . . . . 0.0 110.189 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.798 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.6 mp0 -45.61 -44.32 12.97 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.047 -1.033 . . . . 0.0 109.117 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' B' ' 27' ' ' LEU . 24.7 mt -54.09 -62.74 1.46 Allowed 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.636 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.2 OUTLIER -47.26 -23.17 0.5 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.893 . . . . 0.0 110.072 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 30' ' ' SER . 23.2 mm-40 -75.82 -70.28 0.44 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.976 -1.078 . . . . 0.0 109.99 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 1.169 HD23 ' CE2' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -42.98 -33.03 0.72 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.414 -0.804 . . . . 0.0 109.634 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.979 HD13 HG11 ' B' ' 80' ' ' VAL . 14.5 mt -72.5 -45.24 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.152 -0.967 . . . . 0.0 109.32 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.476 ' OD1' ' HG2' ' B' ' 46' ' ' GLU . 1.9 m-80 -72.6 -9.36 58.49 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.539 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -84.56 -51.21 7.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.913 . . . . 0.0 109.369 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 3' ' ' LEU . 1.3 tt0 -102.67 -43.43 5.6 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.236 -0.915 . . . . 0.0 109.348 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' B' ' 36' ' ' ILE . 1.0 OUTLIER -86.63 58.75 5.24 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 109.484 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' B' ' 37' ' ' ASN . 6.8 p -116.95 36.5 4.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.251 -0.906 . . . . 0.0 109.439 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -130.1 -35.96 1.56 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.233 -0.917 . . . . 0.0 109.451 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.09 -28.95 8.08 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -0.917 . . . . 0.0 109.497 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.812 HD13 ' HB3' ' B' ' 40' ' ' LEU . 8.2 mp -75.93 -15.64 60.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 0.0 109.492 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' B' ' 46' ' ' GLU . 15.2 mt-10 50.63 59.94 4.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.516 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.476 ' HG2' ' OD1' ' B' ' 37' ' ' ASN . 2.9 mt-10 43.94 41.1 3.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.272 -0.893 . . . . 0.0 109.482 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.861 HG13 HG21 ' B' ' 53' ' ' VAL . 1.8 mm 48.25 95.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.242 -0.911 . . . . 0.0 109.293 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.522 ' NZ ' ' HG3' ' B' ' 51' ' ' GLU . 9.8 pttt -43.26 -45.51 5.83 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.238 -0.914 . . . . 0.0 109.544 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.476 ' CG ' ' C ' ' B' ' 48' ' ' LYS . 7.1 mt-10 -154.83 -39.65 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.875 . . . . 0.0 109.301 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 167.72 58.97 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.319 -0.863 . . . . 0.0 109.383 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.522 ' HG3' ' NZ ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -86.45 -70.29 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.34 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.92 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -87.78 -27.11 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.213 -0.929 . . . . 0.0 109.047 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.861 HG21 HG13 ' B' ' 47' ' ' ILE . 54.5 t -68.18 -20.42 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.306 -0.871 . . . . 0.0 109.042 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 4.8 t0 -90.16 -51.37 5.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.354 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -58.06 -33.88 69.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 52' ' ' VAL . 25.3 m -58.56 -50.82 77.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.168 -0.957 . . . . 0.0 109.519 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.603 ' HE1' HD11 ' B' ' 32' ' ' LEU . 0.8 OUTLIER -44.91 -26.25 0.39 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.923 -1.11 . . . . 0.0 109.373 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' B' ' 56' ' ' VAL . 9.8 mt-10 -74.9 -47.08 31.81 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.264 -0.897 . . . . 0.0 108.978 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.464 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 45.0 m -85.01 -63.47 1.32 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.274 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.949 HD21 ' CD1' ' B' ' 76' ' ' PHE . 10.7 mp -38.33 -32.99 0.08 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.608 -0.682 . . . . 0.0 109.902 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.456 ' OD2' ' O ' ' B' ' 57' ' ' MET . 76.0 m-20 -90.15 112.35 23.81 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.182 -0.949 . . . . 0.0 109.553 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.495 ' ND2' ' OE2' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -124.95 -29.3 3.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.225 -0.922 . . . . 0.0 109.641 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.401 ' OD1' ' HG3' ' B' ' 67' ' ' GLU . 1.4 p30 -82.17 -12.18 58.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.225 -0.922 . . . . 0.0 109.612 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 70.08 85.92 0.14 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 12.9 t0 178.14 -32.32 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.321 -1.105 . . . . 0.0 108.678 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.489 ' HA2' ' HE2' ' B' ' 29' ' ' LYS . . . 110.36 38.22 1.67 Allowed Glycine 0 N--CA 1.485 1.938 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -135.42 119.52 17.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.337 -1.096 . . . . 0.0 109.335 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.473 ' SG ' ' N ' ' B' ' 69' ' ' ASP . 16.4 t -69.73 156.96 38.2 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.197 -0.939 . . . . 0.0 109.854 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.504 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.5 OUTLIER -120.64 171.77 8.34 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.709 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -62.6 -50.94 69.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.353 -179.58 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.414 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.8 pt20 -55.45 -40.18 71.25 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.139 -0.975 . . . . 0.0 108.944 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.8 OUTLIER -78.95 -17.9 54.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.314 -0.866 . . . . 0.0 109.184 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 1.048 ' CE2' HD23 ' B' ' 10' ' ' LEU . 5.3 t80 -65.41 -57.34 8.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.877 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -64.01 -42.13 97.24 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.011 -1.056 . . . . 0.0 108.408 179.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.995 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -67.64 -16.34 64.11 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.335 -0.853 . . . . 0.0 108.798 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.949 ' CD1' HD21 ' B' ' 60' ' ' LEU . 2.1 t80 -71.8 -62.63 1.35 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.466 ' HA ' HG23 ' B' ' 80' ' ' VAL . 75.2 t -62.0 -26.77 40.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.845 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -60.77 -44.72 96.4 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.39 -0.819 . . . . 0.0 109.099 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.677 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 12.8 mtp -73.67 -69.88 0.41 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.276 -0.89 . . . . 0.0 109.155 179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.979 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -41.86 -26.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.7 -1.25 . . . . 0.0 109.615 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.502 ' N ' ' O ' ' B' ' 79' ' ' MET . 12.5 m -75.64 -70.09 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.043 -1.036 . . . . 0.0 108.868 178.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.569 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.9 t -78.07 -49.45 13.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.121 -0.987 . . . . 0.0 108.574 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.31 -41.53 0.63 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.257 0.551 . . . . 0.0 109.856 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 6.6 t -81.94 -36.45 27.98 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 109.649 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.4 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.8 t-160 -67.96 -9.95 49.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.165 -0.959 . . . . 0.0 109.658 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.514 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 1.4 pp20? -80.64 -13.43 59.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 109.61 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -52.12 -20.86 2.77 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.168 -0.957 . . . . 0.0 109.545 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.12 -69.44 0.37 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 109.458 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' B' ' 90' ' ' HIS . 1.0 OUTLIER -113.95 -148.91 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' B' ' 89' ' ' GLU . 0.5 OUTLIER 60.97 87.66 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.462 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.445 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.461 ' CB ' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.759 ' OE1' ' HB1' ' B' ' 9' ' ' ALA . 0.2 OUTLIER -63.9 -71.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.784 HD21 ' HZ ' ' B' ' 73' ' ' PHE . 0.9 OUTLIER -68.72 -24.54 64.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.538 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.461 ' HB2' ' CB ' ' A' ' 1' ' ' SER . 0.2 OUTLIER -59.67 -52.8 63.94 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.457 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.53 ' O ' HG12 ' A' ' 8' ' ' VAL . 0.0 OUTLIER -65.86 -48.89 70.06 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.225 -0.922 . . . . 0.0 109.469 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -60.81 -17.47 49.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 6.9 ttp -77.68 -61.43 1.99 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.197 -0.939 . . . . 0.0 109.54 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -49.69 -34.2 8.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.258 -0.902 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -66.4 0.56 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.506 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.47 ' HG ' HD22 ' B' ' 3' ' ' LEU . 0.3 OUTLIER -45.42 -25.73 0.46 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.905 HD13 ' HZ ' ' A' ' 70' ' ' PHE . 17.7 mm -68.93 -53.85 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.267 -0.896 . . . . 0.0 109.498 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.53 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 7.4 t0 -61.48 -18.73 60.35 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.31 -0.869 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.703 HG11 HD11 ' B' ' 3' ' ' LEU . 2.1 t -87.67 -28.84 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.254 -0.904 . . . . 0.0 109.374 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 25' ' ' HIS . 5.1 t80 -70.05 -46.53 64.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.018 -1.051 . . . . 0.0 109.339 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.456 ' HA ' ' HG ' ' A' ' 18' ' ' SER . 15.1 t-80 -80.5 -34.53 35.67 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.329 -0.857 . . . . 0.0 109.711 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.1 tt0 -65.17 -57.74 7.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.2 -0.938 . . . . 0.0 109.606 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.628 ' HE1' HG22 ' A' ' 13' ' ' VAL . 50.6 m-85 -65.45 -33.51 76.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.899 . . . . 0.0 109.569 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.535 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 59.9 p -82.23 0.96 38.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.216 -0.927 . . . . 0.0 109.698 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.94 -22.86 75.95 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 5.2 mtt-85 -77.03 -15.47 59.6 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.261 -1.141 . . . . 0.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -93.52 168.2 11.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 109.439 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -72.73 -38.1 57.07 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 1.8 m-20 -62.47 -34.92 77.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.126 . . . . 0.0 109.439 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 16.6 mtpt 74.97 0.82 3.64 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.639 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.579 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.2 m170 -138.11 7.42 2.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.152 -0.968 . . . . 0.0 109.573 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.535 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.0 OUTLIER -137.83 142.98 40.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.205 -0.934 . . . . 0.0 109.437 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.843 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.7 mp -86.85 161.15 18.48 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.171 -0.956 . . . . 0.0 109.51 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.52 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -126.59 73.73 1.41 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.291 -0.881 . . . . 0.0 109.279 179.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.636 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.6 tttm 63.71 -84.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.607 -0.683 . . . . 0.0 110.267 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.9 m -44.69 -48.24 10.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.168 -0.957 . . . . 0.0 110.535 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.843 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -56.62 -39.86 74.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.926 -1.109 . . . . 0.0 109.358 -179.502 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.925 HD22 HD23 ' A' ' 60' ' ' LEU . 25.0 mt -60.88 -65.81 0.63 Allowed 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.542 -0.724 . . . . 0.0 109.208 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.575 ' HG3' HG11 ' A' ' 53' ' ' VAL . 3.7 ttpt -42.74 -27.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.346 -0.846 . . . . 0.0 109.527 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -67.22 -63.98 0.95 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.211 -0.931 . . . . 0.0 109.353 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.594 ' CD2' HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -44.32 -32.91 1.45 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.879 . . . . 0.0 109.528 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.681 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -70.13 -49.89 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.937 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HD11 ' A' ' 47' ' ' ILE . 2.7 m-20 -86.96 11.91 12.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 109.659 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.417 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -109.46 -40.96 4.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.163 -0.961 . . . . 0.0 109.517 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.628 ' HG2' HD12 ' B' ' 3' ' ' LEU . 0.0 OUTLIER -121.61 -22.53 5.84 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.631 -179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.025 HD22 HD21 ' A' ' 44' ' ' LEU . 16.9 mt -97.18 33.4 1.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.144 -0.973 . . . . 0.0 109.438 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t -88.7 -8.56 54.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.457 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -87.25 -66.16 0.94 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.917 . . . . 0.0 109.506 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.522 ' CE1' ' NE2' ' A' ' 85' ' ' HIS . 2.4 m-85 -59.5 -93.45 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.245 -0.91 . . . . 0.0 109.434 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.025 HD21 HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -49.02 -43.16 40.26 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.161 -0.962 . . . . 0.0 109.318 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.524 ' CG ' ' O ' ' A' ' 44' ' ' LEU . 9.0 pt-20 41.54 27.86 0.07 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.431 -0.793 . . . . 0.0 109.763 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 2.3 tp10 176.7 101.05 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.195 -0.941 . . . . 0.0 109.427 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 1.008 HD13 HG21 ' A' ' 53' ' ' VAL . 33.0 mt -60.94 -18.46 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.213 -0.929 . . . . 0.0 109.529 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.2 mtmt 75.16 26.28 1.24 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.277 -0.89 . . . . 0.0 109.322 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 tt0 83.33 -43.38 0.1 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.693 -0.629 . . . . 0.0 109.802 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.418 ' CD ' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -178.15 54.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.075 -1.015 . . . . 0.0 109.499 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 48' ' ' LYS . 50.2 tp10 -90.03 -70.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.487 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.787 ' O ' HG13 ' A' ' 56' ' ' VAL . 1.7 t -90.97 -16.12 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.173 -0.954 . . . . 0.0 109.316 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.008 HG21 HD13 ' A' ' 47' ' ' ILE . 41.2 t -80.76 -24.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.125 -0.984 . . . . 0.0 108.96 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.82 -33.07 21.43 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 109.119 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -41.97 26.83 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.35 -0.844 . . . . 0.0 109.293 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.958 ' HB ' HD13 ' A' ' 60' ' ' LEU . 28.6 m -58.81 -49.24 83.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 O-C-N 121.251 -0.906 . . . . 0.0 109.493 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.581 ' N ' HG23 ' A' ' 56' ' ' VAL . 4.3 tpt -42.97 -27.01 0.16 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.505 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 56' ' ' VAL . 2.0 tm-20 -79.04 -45.68 19.67 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.266 -0.897 . . . . 0.0 109.114 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 60' ' ' LEU . 22.3 m -79.03 -63.48 1.41 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 109.505 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.958 HD13 ' HB ' ' A' ' 56' ' ' VAL . 7.6 mp -37.92 -43.85 0.73 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.613 -0.679 . . . . 0.0 109.955 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.491 ' OD1' ' CE ' ' A' ' 57' ' ' MET . 8.0 m-20 -90.11 69.99 7.29 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.159 -0.963 . . . . 0.0 109.453 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -95.69 -9.4 32.05 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' O ' ' A' ' 67' ' ' GLU . 2.7 p-10 -78.86 -13.45 59.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.182 -0.948 . . . . 0.0 109.503 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 65.26 83.86 0.09 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 13.5 t0 177.63 -32.74 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.206 -1.173 . . . . 0.0 108.658 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.24 36.57 1.94 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' OD1' ' A' ' 63' ' ' ASP . 39.5 mt-10 -148.94 124.18 10.19 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.299 -1.118 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.527 ' O ' ' CD ' ' A' ' 26' ' ' LYS . 14.0 t -69.9 155.23 40.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.199 -0.938 . . . . 0.0 109.659 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.491 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -115.47 171.27 7.82 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 179.679 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.905 ' HZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -60.77 -49.73 76.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 110.149 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' B' ' 79' ' ' MET . 50.4 mt-30 -54.72 -43.42 72.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 108.997 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.491 ' HG3' ' HB2' ' A' ' 69' ' ' ASP . 1.4 mt-10 -76.78 -16.95 59.32 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.392 -0.818 . . . . 0.0 109.649 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.615 ' CE2' HG12 ' A' ' 13' ' ' VAL . 13.7 t80 -71.08 -52.92 16.67 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.049 -1.032 . . . . 0.0 109.161 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.857 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.6 OUTLIER -65.14 -42.23 94.03 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.162 -0.961 . . . . 0.0 108.785 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -66.7 -25.17 66.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 108.734 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.833 ' CG ' HD21 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.21 -63.0 1.26 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.74 HG12 ' HE1' ' B' ' 7' ' ' MET . 96.9 t -62.59 -25.4 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.313 -0.867 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.85 -29.08 67.33 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.455 -0.778 . . . . 0.0 109.065 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.702 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 19.5 mtp -84.59 -70.88 0.55 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.31 -0.869 . . . . 0.0 109.188 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.924 ' HB ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -44.9 -25.06 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 O-C-N 120.416 -1.428 . . . . 0.0 109.458 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 1.001 HG21 ' SD ' ' B' ' 7' ' ' MET . 41.7 m -81.75 -63.71 1.33 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 108.499 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.657 HG21 ' CB ' ' B' ' 70' ' ' PHE . 2.0 m -79.91 -54.6 5.66 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.702 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.51 -43.7 0.41 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.321 0.581 . . . . 0.0 109.753 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -71.14 -45.16 64.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.405 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.522 ' NE2' ' CE1' ' A' ' 43' ' ' PHE . 1.9 m-70 -62.43 -13.64 32.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.234 -0.916 . . . . 0.0 109.44 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.88 -48.09 17.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.411 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -59.09 -26.82 64.99 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.23 -0.919 . . . . 0.0 109.416 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.77 -38.56 56.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 0.0 109.439 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.53 -68.51 0.47 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.202 -0.937 . . . . 0.0 109.446 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.403 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 15.2 t-80 53.17 44.6 30.06 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.233 -0.917 . . . . 0.0 109.457 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.479 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.427 ' N ' ' HB3' ' B' ' 4' ' ' GLU . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' B' ' 2' ' ' GLU . 1.1 tp10 -64.76 -76.46 0.07 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.249 -0.907 . . . . 0.0 109.444 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.703 HD11 HG11 ' A' ' 13' ' ' VAL . 12.1 mt -69.73 -21.4 63.46 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -0.936 . . . . 0.0 109.438 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.427 ' HB3' ' N ' ' B' ' 1' ' ' SER . 2.9 tt0 -63.92 -51.7 63.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.246 -0.909 . . . . 0.0 109.396 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -43.02 71.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.894 . . . . 0.0 109.4 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.77 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -71.7 -12.3 61.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 1.001 ' SD ' HG21 ' A' ' 81' ' ' THR . 16.7 tpp -83.71 -45.17 13.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 53.2 t -68.63 -34.15 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.759 ' HB1' ' OE1' ' A' ' 2' ' ' GLU . . . -72.07 -58.48 3.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.736 HD12 ' HB1' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -51.95 -55.24 21.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.262 -0.899 . . . . 0.0 109.476 179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.699 HD11 ' CG2' ' A' ' 81' ' ' THR . 21.1 mt -47.85 -46.48 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.301 -0.875 . . . . 0.0 109.5 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' B' ' 16' ' ' GLN . 5.0 t0 -56.63 -42.78 79.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.283 -0.886 . . . . 0.0 109.549 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.692 HG11 HD11 ' A' ' 3' ' ' LEU . 2.2 t -64.27 -25.51 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.243 -0.911 . . . . 0.0 109.572 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 31.1 t80 -72.05 -40.26 68.49 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.938 -1.101 . . . . 0.0 109.596 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.583 ' CE1' ' HG2' ' B' ' 24' ' ' LYS . 18.1 t60 -74.03 -38.2 64.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.915 . . . . 0.0 110.271 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -74.67 -59.62 2.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.68 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.593 ' CD1' HG13 ' B' ' 13' ' ' VAL . 15.6 m-85 -55.01 -31.89 61.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.323 -0.86 . . . . 0.0 109.496 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.563 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.5 p -86.6 -22.02 26.47 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.201 -0.937 . . . . 0.0 109.51 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -83.56 -13.59 75.55 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.527 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 37.6 mtp85 -64.17 -61.88 1.97 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.178 -1.19 . . . . 0.0 109.46 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -133.77 124.98 27.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.66 -108.31 0.82 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -150.8 27.6 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -1.113 . . . . 0.0 109.479 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.583 ' HG2' ' CE1' ' B' ' 15' ' ' HIS . 0.0 OUTLIER 53.82 61.1 3.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 109.464 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.575 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 2.2 m170 -170.14 -35.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.585 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.579 ' CB ' ' CB ' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -129.19 170.35 13.67 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.56 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 31' ' ' GLU . 70.1 mt -119.09 136.97 53.88 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.218 -0.926 . . . . 0.0 110.022 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.46 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -86.6 165.96 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.514 ' CG ' ' SD ' ' B' ' 57' ' ' MET . 0.1 OUTLIER -42.84 -26.94 0.15 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.128 -0.982 . . . . 0.0 109.87 -179.708 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.431 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -78.65 -49.38 13.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.208 -0.932 . . . . 0.0 110.411 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.836 ' HB3' HD22 ' B' ' 27' ' ' LEU . 37.1 mm-40 -55.98 -41.85 75.43 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.982 -1.074 . . . . 0.0 108.663 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.906 HD22 HD12 ' B' ' 60' ' ' LEU . 2.1 mt -57.61 -65.98 0.54 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.792 -0.568 . . . . 0.0 109.615 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.34 -30.96 0.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.367 -0.833 . . . . 0.0 109.648 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -67.91 0.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.923 . . . . 0.0 109.301 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.758 ' CD1' HD13 ' B' ' 27' ' ' LEU . 12.1 mt -45.72 -25.46 0.49 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.302 -0.874 . . . . 0.0 109.547 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.691 HD12 ' O ' ' B' ' 32' ' ' LEU . 0.7 OUTLIER -70.84 -59.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.294 -0.879 . . . . 0.0 108.91 179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' B' ' 42' ' ' HIS . 51.2 m-80 -78.89 4.83 13.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 109.708 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.07 -11.11 9.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.399 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.879 ' OE1' HG13 ' B' ' 77' ' ' VAL . 5.4 tm-20 -101.94 -40.74 6.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.268 -0.895 . . . . 0.0 109.4 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.878 ' HB2' HD22 ' B' ' 44' ' ' LEU . 2.7 mm? -88.22 -46.72 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.255 -0.903 . . . . 0.0 109.393 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.0 t 162.31 -89.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.382 -0.824 . . . . 0.0 109.261 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.514 ' HB3' ' CD2' ' B' ' 43' ' ' PHE . 3.4 m170 -125.02 -47.74 1.77 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.309 -0.869 . . . . 0.0 109.252 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.514 ' CD2' ' HB3' ' B' ' 42' ' ' HIS . 3.9 p90 -151.28 18.34 0.74 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.346 -0.846 . . . . 0.0 109.325 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.878 HD22 ' HB2' ' B' ' 40' ' ' LEU . 0.1 OUTLIER 34.48 39.54 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.859 -0.526 . . . . 0.0 110.275 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.44 ' C ' ' O ' ' B' ' 44' ' ' LEU . 0.2 OUTLIER 42.99 59.65 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.217 -0.927 . . . . 0.0 109.483 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.48 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 6.1 tt0 174.84 -52.85 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.324 -0.86 . . . . 0.0 109.3 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.704 HG13 HD21 ' B' ' 44' ' ' LEU . 14.0 mm -47.47 -90.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.188 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 6.2 mtmt 83.37 -60.12 0.13 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.639 -0.663 . . . . 0.0 109.973 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' HG2' ' B' ' 50' ' ' GLN . 5.4 pt-20 -143.88 -46.55 0.27 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.057 -1.027 . . . . 0.0 109.637 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.7 OUTLIER -164.93 31.05 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.171 -0.955 . . . . 0.0 109.721 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.15 -70.4 0.24 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.101 -1.0 . . . . 0.0 109.082 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.991 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.1 t -84.11 -9.61 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.235 -0.916 . . . . 0.0 109.037 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HG3' ' B' ' 33' ' ' LYS . 2.2 t -82.5 -31.61 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.065 -1.022 . . . . 0.0 109.099 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 1.4 t70 -90.33 -29.57 18.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.411 -0.806 . . . . 0.0 109.191 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -84.39 -44.64 13.54 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.332 -0.855 . . . . 0.0 109.398 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 1.109 HG22 HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -68.2 -42.84 85.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 O-C-N 121.125 -0.984 . . . . 0.0 109.314 179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.514 ' SD ' ' CG ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -39.88 -55.0 2.08 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.652 -0.655 . . . . 0.0 110.318 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -58.44 -40.65 83.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.954 . . . . 0.0 109.323 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.678 HG21 ' SD ' ' B' ' 79' ' ' MET . 99.4 m -67.61 -20.2 65.32 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 110.356 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 1.109 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -82.2 -72.48 0.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.932 -1.105 . . . . 0.0 109.151 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.26 100.96 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.267 -0.896 . . . . 0.0 109.496 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.92 9.08 4.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.275 -0.891 . . . . 0.0 109.545 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.91 -29.78 9.27 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.936 . . . . 0.0 109.405 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.05 90.76 2.13 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -175.26 -36.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.257 -1.143 . . . . 0.0 108.521 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 -12.9 50.68 Favored Glycine 0 N--CA 1.486 1.986 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.579 ' CB ' ' CB ' ' B' ' 26' ' ' LYS . 1.7 mm-40 -112.24 150.54 30.77 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.257 -1.143 . . . . 0.0 109.457 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.903 ' SG ' HD21 ' B' ' 32' ' ' LEU . 7.2 m -73.74 155.77 38.58 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.203 -0.936 . . . . 0.0 110.199 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.41 171.5 7.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.481 -0.762 . . . . 0.0 109.196 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.688 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -57.88 -53.63 56.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.238 -0.914 . . . . 0.0 110.672 -179.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.495 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 1.9 pt20 -62.31 -29.99 70.83 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.23 -0.919 . . . . 0.0 108.687 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.486 ' HG2' ' HB3' ' B' ' 68' ' ' CYS . 1.1 tt0 -81.78 -15.25 54.86 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.784 ' HZ ' HD21 ' A' ' 3' ' ' LEU . 5.7 t80 -75.35 -52.3 11.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.185 -0.947 . . . . 0.0 108.938 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.819 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -66.64 -45.82 77.78 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.275 -0.891 . . . . 0.0 109.188 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 1.056 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.09 -43.41 91.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 108.922 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.668 ' CE1' HD11 ' B' ' 36' ' ' ILE . 0.2 OUTLIER -49.15 -60.11 3.08 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.472 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.879 HG13 ' OE1' ' B' ' 39' ' ' GLU . 44.0 t -59.92 -25.57 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 O-C-N 121.342 -0.848 . . . . 0.0 108.714 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.857 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -60.86 -37.31 81.69 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.52 -0.737 . . . . 0.0 109.207 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.704 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 1.1 mtm -79.11 -66.79 0.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.325 -0.859 . . . . 0.0 109.498 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.991 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -47.95 -22.43 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 O-C-N 120.473 -1.392 . . . . 0.0 109.218 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 16.3 m -78.42 -66.44 0.85 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.059 -1.026 . . . . 0.0 108.915 178.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.8 t -81.37 -49.84 10.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.995 . . . . 0.0 108.756 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.85 -35.92 0.17 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.807 -0.558 . . . . 0.0 109.605 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' B' ' 44' ' ' LEU . 10.0 t -67.07 -52.89 36.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.367 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.49 -10.4 51.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.225 -0.922 . . . . 0.0 109.543 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -90.14 -34.56 15.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.193 -0.942 . . . . 0.0 109.493 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.65 -33.07 70.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.901 . . . . 0.0 109.483 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -47.49 -65.99 0.48 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.241 -0.912 . . . . 0.0 109.493 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -160.52 174.74 13.61 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.247 -0.908 . . . . 0.0 109.464 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.438 ' O ' ' O ' ' B' ' 91' ' ' GLU . 0.4 OUTLIER 61.6 95.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.255 -0.903 . . . . 0.0 109.504 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.438 ' O ' ' O ' ' B' ' 90' ' ' HIS . 39.2 mt-10 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.497 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.659 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.3 mp0 -73.96 -71.24 0.34 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.299 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.769 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.4 mp -61.48 -18.02 57.15 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.342 -0.849 . . . . 0.0 109.404 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.456 ' O ' ' CG ' ' A' ' 7' ' ' MET . 5.2 tt0 -68.89 -66.98 0.51 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.074 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.523 ' HA ' HG22 ' A' ' 8' ' ' VAL . 2.5 ttmt -65.49 -14.59 61.33 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.278 -0.889 . . . . 0.0 109.055 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.753 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -82.81 -29.4 29.55 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.332 -0.855 . . . . 0.0 109.117 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.473 ' HG3' ' N ' ' A' ' 8' ' ' VAL . 3.7 ptp -83.33 -23.77 32.39 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 109.251 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.554 HG23 ' N ' ' A' ' 9' ' ' ALA . 32.9 m -80.39 -44.33 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.261 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -71.23 -36.38 71.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.456 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.837 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -75.15 -54.18 7.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 109.626 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.837 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -46.62 -45.86 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.098 -1.001 . . . . 0.0 109.352 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.552 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -67.8 -34.17 76.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.192 -0.942 . . . . 0.0 109.583 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.03 HG11 HD21 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -73.97 -15.42 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.655 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.2 t80 -85.78 -41.88 14.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.01 -1.056 . . . . 0.0 109.281 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.459 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 10.6 m170 -74.47 -28.91 61.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.284 -0.885 . . . . 0.0 109.352 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -79.74 -60.29 2.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.911 . . . . 0.0 109.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.574 ' HB3' HD21 ' A' ' 27' ' ' LEU . 37.9 m-85 -59.0 -46.09 89.02 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.497 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 p -75.05 -11.94 60.21 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 109.481 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.545 ' HA3' ' CG ' ' A' ' 24' ' ' LYS . . . -94.99 26.62 18.0 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.48 ' HD2' ' O ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -90.06 -16.83 28.91 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -1.151 . . . . 0.0 109.569 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 23' ' ' ASP . 27.2 mt-10 -105.44 69.35 0.83 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.146 -0.971 . . . . 0.0 109.683 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.446 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . 39.58 28.43 0.12 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' N ' ' O ' ' A' ' 21' ' ' GLU . 11.9 t70 -179.47 137.26 0.13 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.098 -1.236 . . . . 0.0 109.662 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.545 ' CG ' ' HA3' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -108.83 112.94 25.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.304 -0.872 . . . . 0.0 109.383 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.459 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 3.0 t-80 -170.07 -35.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.265 -0.897 . . . . 0.0 109.642 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.54 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -145.06 170.2 16.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.814 HD23 ' C ' ' A' ' 31' ' ' GLU . 1.7 mp -117.79 128.0 54.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.236 -0.915 . . . . 0.0 110.032 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.547 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -74.26 161.39 29.97 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.316 -1.365 . . . . 0.0 107.316 178.005 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.547 ' N ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -28.93 0.24 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.873 -1.142 . . . . 0.0 109.488 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 28' ' ' LYS . 3.0 m -82.29 -40.73 21.11 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.376 -0.827 . . . . 0.0 110.164 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.814 ' C ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -58.64 -40.35 83.17 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.794 -1.191 . . . . 0.0 108.483 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.866 HD21 ' SG ' ' A' ' 68' ' ' CYS . 17.8 mt -62.94 -61.83 2.13 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.678 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.31 -27.22 0.14 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 109.757 -179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.28 -67.33 0.76 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.661 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.03 HD21 HG11 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -42.02 -30.73 0.29 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.424 -0.797 . . . . 0.0 110.086 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.052 HD12 HG21 ' A' ' 80' ' ' VAL . 6.0 mm -85.38 -41.86 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.187 -0.945 . . . . 0.0 109.421 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.774 HD21 HG21 ' A' ' 47' ' ' ILE . 2.2 m-80 -87.51 11.6 14.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.551 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.482 ' HB3' ' OH ' ' A' ' 17' ' ' TYR . 2.0 m-80 -118.09 -44.72 2.68 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.448 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HB3' ' HB2' ' B' ' 3' ' ' LEU . 13.8 mm-40 -109.32 -9.89 14.96 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.278 -0.889 . . . . 0.0 109.49 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.662 HD11 HG13 ' A' ' 77' ' ' VAL . 5.6 mp -119.63 41.78 3.05 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 109.471 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.472 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 35.3 p -122.42 12.05 10.06 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.495 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -105.5 -60.34 1.64 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.211 -0.93 . . . . 0.0 109.426 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -89.74 0.07 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.885 . . . . 0.0 109.498 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.686 HD22 ' HA ' ' A' ' 81' ' ' THR . 2.0 pp -49.57 -28.7 5.92 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.232 -0.918 . . . . 0.0 109.406 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.473 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 13.9 mt-10 43.21 -96.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.348 -0.845 . . . . 0.0 109.47 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.519 ' OE1' ' CG2' ' A' ' 52' ' ' VAL . 0.3 OUTLIER 42.15 -157.86 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.233 -0.917 . . . . 0.0 109.556 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.774 HG21 HD21 ' A' ' 37' ' ' ASN . 8.6 mt 56.29 163.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.227 -0.921 . . . . 0.0 109.394 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.517 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 6.4 ptmt 163.23 -34.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.286 -0.883 . . . . 0.0 109.384 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.5 ' HG3' ' HG3' ' A' ' 50' ' ' GLN . 25.3 pt-20 -140.43 -38.44 0.44 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.87 . . . . 0.0 109.412 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.5 ' HG3' ' HG3' ' A' ' 49' ' ' GLU . 2.2 pt20 167.72 48.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.202 -0.936 . . . . 0.0 109.612 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.67 -70.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.178 -0.951 . . . . 0.0 109.281 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.956 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.3 t -91.63 -12.96 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.212 -0.93 . . . . 0.0 108.878 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.678 HG11 ' HD3' ' A' ' 33' ' ' LYS . 35.8 t -82.58 -27.51 8.58 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 O-C-N 121.14 -0.975 . . . . 0.0 108.84 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -90.46 -34.37 15.62 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.475 -0.766 . . . . 0.0 109.106 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -81.15 -45.15 16.83 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.342 -0.849 . . . . 0.0 109.407 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 1.067 HG22 HD21 ' A' ' 60' ' ' LEU . 1.3 p -64.9 -44.04 96.24 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.064 -1.023 . . . . 0.0 109.303 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.586 ' CE ' ' CD1' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -41.01 -47.58 3.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.584 -0.698 . . . . 0.0 109.922 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.06 -44.61 97.12 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.185 -0.947 . . . . 0.0 108.848 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 59' ' ' THR . 17.7 m -73.24 -8.95 58.04 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.444 -0.785 . . . . 0.0 109.608 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.067 HD21 HG22 ' A' ' 56' ' ' VAL . 2.9 mt -85.66 -74.69 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.145 -0.972 . . . . 0.0 109.388 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.71 93.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.61 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.26 13.32 34.7 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.261 -0.899 . . . . 0.0 109.412 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.02 -45.34 2.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.308 -0.87 . . . . 0.0 109.541 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.07 91.16 2.15 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -174.62 -36.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.301 -1.117 . . . . 0.0 108.492 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 39.81 2.12 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.735 -1.346 . . . . 0.0 109.735 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.54 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -156.38 113.39 3.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -1.157 . . . . 0.0 109.331 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' A' ' 32' ' ' LEU . 94.9 m -69.8 157.77 36.73 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.215 -0.928 . . . . 0.0 110.076 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 72' ' ' GLU . 1.0 OUTLIER -118.42 170.6 8.79 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.323 -0.861 . . . . 0.0 109.093 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.433 ' O ' ' C ' ' A' ' 71' ' ' GLN . 0.1 OUTLIER -50.56 -64.76 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.366 -0.834 . . . . 0.0 111.293 -179.216 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 5.4 pt20 -45.28 -27.95 0.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.039 -1.038 . . . . 0.0 108.732 -179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.615 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . 3.3 mt-10 -77.58 -41.8 37.51 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.501 -0.75 . . . . 0.0 110.009 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CE2' HD23 ' A' ' 10' ' ' LEU . 2.6 t80 -51.51 -50.41 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.81 -1.182 . . . . 0.0 109.016 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.851 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mtp -62.81 -38.7 91.75 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.5 -0.75 . . . . 0.0 109.347 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -69.6 -16.67 63.44 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.172 -0.955 . . . . 0.0 108.787 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.934 ' CD1' HD22 ' A' ' 60' ' ' LEU . 15.0 m-30 -75.14 -70.05 0.44 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.711 ' CG2' HD23 ' B' ' 3' ' ' LEU . 99.2 t -52.1 -29.97 12.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 119.863 -0.735 . . . . 0.0 109.056 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.906 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -62.93 -44.45 96.05 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.679 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.8 OUTLIER -76.3 -69.64 0.49 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 109.968 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 1.052 HG21 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.85 -23.38 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.786 0 O-C-N 120.575 -1.328 . . . . 0.0 109.717 -178.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.686 ' HA ' HD22 ' A' ' 44' ' ' LEU . 15.7 m -80.4 -67.81 0.74 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.893 -1.129 . . . . 0.0 108.927 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.1 t -77.32 -49.72 14.37 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.95 . . . . 0.0 108.768 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.87 -30.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.408 0.623 . . . . 0.0 109.557 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.474 ' N ' ' O ' ' A' ' 82' ' ' THR . 42.9 t -89.66 -41.66 11.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.312 -0.868 . . . . 0.0 109.448 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.411 ' N ' ' O ' ' A' ' 82' ' ' THR . 36.1 t60 -63.19 -11.92 24.42 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.633 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' OE1' ' HA ' ' A' ' 86' ' ' GLU . 6.2 tp10 -82.06 -35.65 28.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.94 . . . . 0.0 109.442 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -26.79 49.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.3 -0.875 . . . . 0.0 109.492 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -69.59 -23.23 63.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.275 -0.891 . . . . 0.0 109.505 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -128.72 91.71 3.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.483 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 -86.38 144.88 27.11 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.251 -0.905 . . . . 0.0 109.46 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.468 179.987 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.459 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.808 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 5.2 mm-40 -64.82 -54.87 24.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.276 -0.89 . . . . 0.0 109.301 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.711 HD23 ' CG2' ' A' ' 77' ' ' VAL . 6.0 mp -70.98 -19.72 62.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.308 -0.87 . . . . 0.0 109.402 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.459 ' HB2' ' N ' ' B' ' 1' ' ' SER . 15.2 tp10 -63.05 -56.02 20.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.229 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.494 ' HD3' ' HD2' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -64.69 -39.2 93.26 Favored 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.261 -0.899 . . . . 0.0 108.758 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.633 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -69.73 -16.12 63.27 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.299 -0.876 . . . . 0.0 109.106 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.946 ' CE ' HD13 ' B' ' 11' ' ' ILE . 6.5 tpt -77.23 -50.55 12.67 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.417 -0.802 . . . . 0.0 109.26 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.45 ' C ' HG22 ' B' ' 11' ' ' ILE . 12.2 p -65.29 -31.03 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 O-C-N 121.234 -0.916 . . . . 0.0 109.476 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.659 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -79.88 -69.76 0.56 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.932 . . . . 0.0 109.564 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.753 HD11 ' HB1' ' A' ' 6' ' ' ALA . 36.7 mt -43.91 -45.74 7.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 109.59 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.946 HD13 ' CE ' ' B' ' 7' ' ' MET . 0.5 OUTLIER -61.08 -46.66 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.204 -0.935 . . . . 0.0 109.449 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.584 ' N ' HG23 ' B' ' 11' ' ' ILE . 40.5 t0 -65.68 -15.2 62.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.276 -0.89 . . . . 0.0 109.475 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.653 HG21 ' HB2' ' A' ' 2' ' ' GLU . 2.2 t -89.7 -31.45 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 0.0 109.269 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.572 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 8.1 t80 -69.28 -46.13 67.95 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 120.995 -1.066 . . . . 0.0 109.123 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -78.14 -39.61 40.59 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.4 tt0 -62.92 -63.33 1.24 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 109.457 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.619 ' CD2' ' CD2' ' B' ' 35' ' ' LEU . 28.5 m-85 -53.7 -41.12 66.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.259 -0.9 . . . . 0.0 109.541 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.523 ' HB3' ' N ' ' B' ' 25' ' ' HIS . 1.7 m -61.51 -32.68 72.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.215 -0.928 . . . . 0.0 109.665 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.55 31.12 5.97 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.5 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 27.6 mmm180 -90.08 -30.84 17.44 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.15 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.446 ' O ' ' O ' ' B' ' 22' ' ' GLY . 4.6 mt-10 -153.71 93.99 1.73 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 109.525 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . 57.99 158.16 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' C ' ' CG ' ' B' ' 24' ' ' LYS . 10.7 m-20 60.3 155.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.495 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.444 ' CG ' ' C ' ' B' ' 23' ' ' ASP . 0.9 OUTLIER -154.41 63.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.572 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -170.03 -35.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -118.98 167.27 11.91 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.282 -0.886 . . . . 0.0 109.588 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' B' ' 31' ' ' GLU . 79.6 mt -118.07 121.2 39.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.803 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.676 ' O ' HD12 ' B' ' 32' ' ' LEU . 0.2 OUTLIER -73.08 168.13 19.7 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.179 -0.951 . . . . 0.0 108.655 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -43.34 -26.95 0.22 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.16 -0.962 . . . . 0.0 109.537 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.423 ' N ' ' O ' ' B' ' 28' ' ' LYS . 31.2 m -74.5 -62.41 1.53 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.288 -0.883 . . . . 0.0 109.975 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.936 ' HB3' HD22 ' B' ' 27' ' ' LEU . 48.2 mm-40 -45.72 -42.47 11.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.092 -1.005 . . . . 0.0 109.223 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 1.053 HD22 ' HE3' ' B' ' 57' ' ' MET . 4.3 mp -55.29 -69.44 0.13 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.601 -0.687 . . . . 0.0 109.264 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.999 ' HD3' HG11 ' B' ' 53' ' ' VAL . 4.5 mmtp -38.95 -32.47 0.09 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.465 -0.772 . . . . 0.0 109.744 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' B' ' 38' ' ' ASN . 0.3 OUTLIER -65.8 -63.85 1.0 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.307 -0.87 . . . . 0.0 109.237 179.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 3' ' ' LEU . 3.9 mm? -44.43 -26.15 0.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.299 -0.875 . . . . 0.0 109.464 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.913 HG13 HG22 ' B' ' 53' ' ' VAL . 1.1 mm -75.01 -61.97 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.472 ' OD1' ' HA ' ' B' ' 46' ' ' GLU . 24.5 m-80 -87.91 18.75 3.94 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.706 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 23.4 t-20 -114.54 -44.91 3.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.245 -0.909 . . . . 0.0 109.261 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 18.3 mm-40 -123.46 -9.99 7.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.332 -0.855 . . . . 0.0 109.451 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.858 ' HB3' HD11 ' B' ' 44' ' ' LEU . 18.4 mt -109.06 52.86 0.7 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.442 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.0 m -99.05 3.79 46.91 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.569 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.75 -81.63 0.14 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.923 . . . . 0.0 109.398 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -65.02 -74.32 0.11 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.463 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.858 HD11 ' HB3' ' B' ' 40' ' ' LEU . 0.3 OUTLIER -69.03 97.57 0.88 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.466 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.423 ' O ' ' O ' ' B' ' 44' ' ' LEU . 0.0 OUTLIER -43.89 -90.62 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.281 -0.887 . . . . 0.0 109.499 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.472 ' HA ' ' OD1' ' B' ' 37' ' ' ASN . 0.7 OUTLIER -126.02 52.63 1.67 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 109.436 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.932 ' CD1' HG21 ' B' ' 53' ' ' VAL . 42.8 mt 61.48 135.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.427 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.53 ' HB2' ' CG ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -86.26 61.37 6.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.224 -0.923 . . . . 0.0 109.393 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' B' ' 50' ' ' GLN . 0.5 OUTLIER 64.13 59.24 1.08 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.288 -0.883 . . . . 0.0 109.307 -179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' B' ' 49' ' ' GLU . 4.2 mt-30 65.33 48.93 2.01 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.269 -0.894 . . . . 0.0 109.324 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.53 ' CG ' ' HB2' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -88.8 -70.15 0.66 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.211 -0.931 . . . . 0.0 109.568 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 1.004 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -91.46 -12.88 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.449 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.999 HG11 ' HD3' ' B' ' 33' ' ' LYS . 75.3 t -84.34 -25.28 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.051 -1.031 . . . . 0.0 108.793 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -88.22 -33.93 17.95 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.94 -51.28 8.23 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.429 -0.795 . . . . 0.0 108.956 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.898 ' O ' HD12 ' B' ' 60' ' ' LEU . 1.3 p -59.59 -40.61 82.54 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 O-C-N 121.208 -0.932 . . . . 0.0 108.92 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 1.053 ' HE3' HD22 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -42.17 -48.39 4.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.578 -0.701 . . . . 0.0 109.42 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -62.61 -43.2 99.41 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.291 -0.881 . . . . 0.0 109.071 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.417 ' O ' HG22 ' B' ' 59' ' ' THR . 8.3 m -66.27 -13.69 60.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.317 -0.864 . . . . 0.0 109.31 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 1.013 HD22 ' CD2' ' B' ' 32' ' ' LEU . 2.1 mp -95.29 -28.79 14.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.268 -0.895 . . . . 0.0 109.469 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.417 ' O ' ' C ' ' B' ' 62' ' ' ASN . 0.5 OUTLIER -65.46 114.32 4.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.214 -0.929 . . . . 0.0 109.535 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' B' ' 61' ' ' ASP . 0.4 OUTLIER -44.31 -37.65 3.42 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.324 -0.86 . . . . 0.0 109.363 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 179.29 32.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.3 -0.875 . . . . 0.0 109.675 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 93.44 1.71 Allowed Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.52 -35.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.339 -1.095 . . . . 0.0 108.446 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 101.36 38.61 3.23 Favored Glycine 0 N--CA 1.484 1.856 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.504 ' CB ' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -143.5 104.39 4.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -1.134 . . . . 0.0 109.425 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.521 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.6 t -69.69 156.54 38.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.858 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.5 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -115.46 171.61 7.61 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.483 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -59.03 -50.84 72.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.156 -0.965 . . . . 0.0 110.357 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.491 ' HB3' ' CE ' ' A' ' 79' ' ' MET . 0.9 OUTLIER -56.24 -39.4 72.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.254 -0.904 . . . . 0.0 109.161 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.505 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -79.59 -16.07 56.52 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.463 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.538 ' CZ ' HG12 ' B' ' 13' ' ' VAL . 54.3 t80 -69.46 -56.3 7.81 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.224 -0.922 . . . . 0.0 108.705 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.906 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 10.7 mtt -63.74 -49.32 73.48 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.468 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.44 -26.36 65.13 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.304 -0.872 . . . . 0.0 108.963 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.663 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.1 OUTLIER -64.6 -70.59 0.22 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.408 -0.807 . . . . 0.0 108.862 179.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.577 HG21 ' CD2' ' A' ' 3' ' ' LEU . 87.9 t -56.42 -20.61 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.25 -0.906 . . . . 0.0 108.958 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -64.25 -54.38 34.22 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.46 -0.775 . . . . 0.0 109.423 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.633 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.4 OUTLIER -68.24 -61.36 1.88 Allowed 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.345 -0.847 . . . . 0.0 109.652 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 1.004 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -48.43 -22.08 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.361 -1.462 . . . . 0.0 109.376 -179.402 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' B' ' 77' ' ' VAL . 3.6 m -79.23 -69.94 0.54 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.039 -1.038 . . . . 0.0 109.185 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.8 t -73.82 -49.17 26.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.063 -1.023 . . . . 0.0 109.227 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.55 -43.84 0.42 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.756 -0.59 . . . . 0.0 109.893 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.53 -50.33 71.8 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.282 -0.886 . . . . 0.0 109.469 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -10.12 49.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.295 -0.878 . . . . 0.0 109.53 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' B' ' 82' ' ' THR . 20.9 mt-10 -73.72 -19.02 60.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 109.539 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -50.6 -22.26 1.93 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.216 -0.928 . . . . 0.0 109.512 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -70.37 -47.43 60.97 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.246 -0.908 . . . . 0.0 109.499 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' B' ' 90' ' ' HIS . 11.7 tt0 65.34 25.95 12.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.486 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.58 ' N ' ' CD2' ' B' ' 90' ' ' HIS . 4.5 m170 69.62 124.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.483 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.28 0.562 . . . . 0.0 109.487 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.705 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -64.05 -70.82 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.225 -0.922 . . . . 0.0 109.525 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.069 HD13 HD23 ' B' ' 10' ' ' LEU . 3.7 mm? -75.37 -32.5 60.85 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.468 ' HB2' ' HB2' ' A' ' 1' ' ' SER . 0.0 OUTLIER -60.25 -60.29 4.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.272 -0.892 . . . . 0.0 109.559 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -63.07 -30.51 71.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.238 -0.914 . . . . 0.0 109.507 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.725 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -75.4 -18.12 60.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.484 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.454 ' O ' ' HB ' ' A' ' 11' ' ' ILE . 42.4 ttm -80.93 -48.88 11.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.459 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 42.5 t -68.29 -29.62 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 109.508 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -69.9 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.597 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.567 ' CD2' HD23 ' B' ' 3' ' ' LEU . 13.2 mt -46.0 -47.01 16.8 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 0.0 109.559 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.891 HD11 HG21 ' B' ' 81' ' ' THR . 12.3 mt -60.39 -41.16 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.933 . . . . 0.0 109.491 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.499 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 37.6 t0 -63.03 -21.4 66.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.493 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.027 HG21 HD11 ' B' ' 3' ' ' LEU . 2.3 t -84.11 -31.37 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.928 . . . . 0.0 109.391 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.524 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 15.1 t80 -68.0 -44.66 76.08 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.017 -1.052 . . . . 0.0 109.21 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.515 ' CD2' ' HD3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -80.83 -41.13 23.75 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.296 -0.877 . . . . 0.0 109.501 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.499 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 9.8 tt0 -60.16 -61.63 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.95 . . . . 0.0 109.443 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.656 ' CG ' HD21 ' A' ' 35' ' ' LEU . 32.7 m-85 -57.28 -50.66 72.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.473 ' OG ' ' HA ' ' A' ' 24' ' ' LYS . 38.1 t -61.24 -18.72 59.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.618 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -64.68 -31.8 82.1 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.428 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -70.3 -43.38 70.51 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.273 -1.134 . . . . 0.0 109.481 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HG2' ' HB2' ' A' ' 28' ' ' LYS . 22.2 tp10 -97.06 135.04 39.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.263 -0.898 . . . . 0.0 109.442 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 52.85 -145.78 19.46 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.458 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 0.4 OUTLIER -80.38 -74.65 0.3 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.268 -1.137 . . . . 0.0 109.491 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HD3' ' CD2' ' A' ' 15' ' ' HIS . 0.0 OUTLIER 168.79 46.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 109.424 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.32 -14.72 7.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.233 -0.917 . . . . 0.0 109.695 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' CG ' ' HB3' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -149.04 170.08 19.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.235 -0.915 . . . . 0.0 109.613 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.904 HD22 ' HB3' ' A' ' 31' ' ' GLU . 96.4 mt -118.01 127.08 53.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.776 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' A' ' 29' ' ' LYS . 4.3 tttp -69.81 152.89 44.05 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' N ' ' A' ' 30' ' ' SER . 4.2 ptpt -37.14 -30.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.453 -0.779 . . . . 0.0 109.847 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.51 ' N ' ' HG3' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -74.97 -50.9 15.11 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.247 -0.908 . . . . 0.0 109.38 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.904 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.1 mp0 -49.91 -43.81 49.87 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 108.905 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.948 HD12 ' SD ' ' A' ' 57' ' ' MET . 31.3 mt -57.15 -66.82 0.39 Allowed 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.673 -0.642 . . . . 0.0 109.275 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.958 ' HG2' HG11 ' A' ' 53' ' ' VAL . 2.5 mttp -41.35 -31.35 0.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -0.835 . . . . 0.0 109.779 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -64.54 -68.61 0.34 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.18 -0.95 . . . . 0.0 109.35 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.656 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.1 mm? -44.04 -44.79 7.61 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.693 HD13 HG22 ' A' ' 53' ' ' VAL . 1.5 mp -53.4 -48.09 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.202 -0.937 . . . . 0.0 109.631 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' C ' ' A' ' 38' ' ' ASN . 3.2 m120 -73.97 -67.26 0.62 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.111 -0.993 . . . . 0.0 110.055 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.441 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.5 OUTLIER -40.83 -70.49 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.442 -0.786 . . . . 0.0 110.269 -179.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 77' ' ' VAL . 31.5 tt0 -67.59 -51.8 46.08 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.174 -0.954 . . . . 0.0 110.026 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.958 ' HB3' HD13 ' A' ' 44' ' ' LEU . 2.4 mp -98.15 65.85 1.76 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.199 -0.938 . . . . 0.0 109.572 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -95.22 1.54 54.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.321 -0.862 . . . . 0.0 109.606 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -78.96 -68.36 0.66 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.516 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.416 ' C ' HD12 ' A' ' 44' ' ' LEU . 66.6 m-85 -100.85 12.34 37.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.263 -0.898 . . . . 0.0 109.435 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.958 HD13 ' HB3' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -146.56 31.69 0.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.475 -179.949 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.484 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 10.4 tp10 -43.79 -75.03 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' A' ' 47' ' ' ILE . 5.7 tm-20 -113.35 30.02 7.53 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.27 -0.894 . . . . 0.0 109.312 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.555 ' CD1' HG21 ' A' ' 53' ' ' VAL . 1.5 mt 55.91 106.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.887 . . . . 0.0 109.255 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -43.03 -27.15 0.18 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.3 -0.875 . . . . 0.0 109.562 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.52 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 1.5 mm-40 164.23 63.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.398 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 2.9 mm-40 51.62 48.82 22.15 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.253 -0.905 . . . . 0.0 109.329 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -87.49 -70.07 0.65 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.588 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -88.16 -22.42 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.226 -0.921 . . . . 0.0 109.601 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.958 HG11 ' HG2' ' A' ' 33' ' ' LYS . 78.8 t -78.9 -29.93 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.068 -1.02 . . . . 0.0 109.262 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 19.5 t0 -77.12 -49.31 15.54 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.272 -0.892 . . . . 0.0 109.221 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -50.35 51.37 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.662 ' O ' HG22 ' A' ' 59' ' ' THR . 1.9 p -58.43 -49.35 82.45 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.09 -1.007 . . . . 0.0 109.072 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.948 ' SD ' HD12 ' A' ' 32' ' ' LEU . 8.5 tpt -41.53 -44.31 2.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.79 . . . . 0.0 109.802 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 26.1 mt-10 -57.01 -48.19 79.06 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.23 -0.919 . . . . 0.0 109.424 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.861 HG21 ' CE ' ' A' ' 79' ' ' MET . 4.7 t -76.23 -9.7 58.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.278 -0.889 . . . . 0.0 109.977 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.651 HD11 ' CD1' ' A' ' 76' ' ' PHE . 16.7 mt -87.27 3.05 48.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.491 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 61' ' ' ASP . 17.8 p-10 -85.46 114.59 22.61 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.17 -0.956 . . . . 0.0 109.47 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -52.45 -22.0 4.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.506 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 176.99 40.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.91 . . . . 0.0 109.472 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.419 ' O ' ' CG ' ' A' ' 65' ' ' ASP . . . 77.63 90.36 0.32 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' CG ' ' O ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 176.28 -32.46 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.277 -1.131 . . . . 0.0 108.579 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.12 -22.36 23.16 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mm-40 -70.01 106.94 3.4 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -1.115 . . . . 0.0 109.389 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 14.2 t -69.92 157.08 38.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.266 -0.896 . . . . 0.0 109.679 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.506 ' HB3' ' HG3' ' A' ' 72' ' ' GLU . 34.3 t0 -117.58 171.26 8.13 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -58.74 -50.3 74.43 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.479 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 2.3 mp0 -56.81 -40.22 75.57 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.819 . . . . 0.0 108.983 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 mt-10 -76.63 -17.15 59.33 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 109.428 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.476 ' O ' ' HB3' ' A' ' 76' ' ' PHE . 26.4 t80 -71.54 -49.56 39.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.19 -0.944 . . . . 0.0 108.966 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.936 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 9.6 mmt -66.04 -54.31 27.45 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.312 -0.867 . . . . 0.0 109.034 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -60.63 -26.3 66.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.24 -0.913 . . . . 0.0 108.999 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CD1' HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.25 -68.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 39' ' ' GLU . 53.4 t -62.75 -20.53 25.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.835 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -69.19 -30.86 69.15 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.447 -0.783 . . . . 0.0 109.269 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.861 ' CE ' HG21 ' A' ' 59' ' ' THR . 20.7 mtp -85.47 -67.53 0.8 Allowed 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.838 0.827 . . . . 0.0 109.072 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.946 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.15 -22.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.959 0 O-C-N 120.4 -1.438 . . . . 0.0 109.505 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.57 ' CA ' HD21 ' A' ' 40' ' ' LEU . 45.2 m -85.15 -61.1 1.85 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.007 -1.058 . . . . 0.0 108.468 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.554 HG21 ' CB ' ' B' ' 70' ' ' PHE . 1.4 m -80.28 -55.27 5.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.32 -42.12 0.19 Allowed 'General case' 0 N--CA 1.496 1.846 0 CA-C-O 121.276 0.56 . . . . 0.0 109.933 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 87' ' ' PHE . 30.4 t -69.03 -58.88 3.51 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.912 . . . . 0.0 109.463 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.421 ' C ' ' O ' ' A' ' 84' ' ' CYS . 2.1 t60 -44.5 -64.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.225 -0.922 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -49.12 -36.02 17.92 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.52 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.45 ' HB2' ' O ' ' A' ' 84' ' ' CYS . 0.2 OUTLIER -57.97 -47.76 81.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.309 -0.869 . . . . 0.0 109.474 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.491 ' O ' ' CB ' ' A' ' 89' ' ' GLU . 8.9 m-85 -60.95 -35.95 78.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.205 -0.934 . . . . 0.0 109.442 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.491 ' CB ' ' O ' ' A' ' 88' ' ' PHE . 1.6 tt0 74.31 -164.86 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.269 -0.895 . . . . 0.0 109.484 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.25 54.35 0.97 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.274 -0.891 . . . . 0.0 109.459 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.487 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.489 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 58.4 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.73 -74.9 0.08 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.291 -0.881 . . . . 0.0 109.488 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 1.027 HD11 HG21 ' A' ' 13' ' ' VAL . 3.3 mp -71.16 -28.08 64.0 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.941 . . . . 0.0 109.488 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.489 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 34.4 tt0 -58.13 -58.3 9.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.394 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.0 OUTLIER -59.49 -50.97 71.85 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.291 -0.88 . . . . 0.0 109.336 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.655 ' O ' HD12 ' B' ' 10' ' ' LEU . . . -61.88 -14.78 37.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.447 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.473 ' HG3' ' OE2' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -76.39 -53.64 7.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 -179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.425 ' H ' HG23 ' B' ' 8' ' ' VAL . 2.7 t -62.62 -27.69 43.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.705 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -80.17 -69.86 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 1.069 HD23 HD13 ' A' ' 3' ' ' LEU . 12.1 mt -44.4 -53.17 7.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 109.487 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.752 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 22.1 mm -55.61 -58.22 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.343 -0.848 . . . . 0.0 109.886 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -51.4 -19.92 1.56 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.034 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 1.002 HG13 HD21 ' B' ' 35' ' ' LEU . 1.0 OUTLIER -88.58 -36.28 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.034 -1.041 . . . . 0.0 109.595 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.553 ' CD1' ' HB2' ' B' ' 73' ' ' PHE . 27.3 t80 -58.86 -41.64 87.49 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.777 -1.202 . . . . 0.0 108.837 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' B' ' 16' ' ' GLN . 0.3 OUTLIER -80.7 -46.25 15.84 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.334 -0.853 . . . . 0.0 109.252 179.727 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' B' ' 15' ' ' HIS . 1.7 tt0 -44.72 -40.17 5.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 108.685 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.521 ' O ' ' N ' ' B' ' 19' ' ' GLY . 3.9 m-85 -91.36 -79.23 0.37 Allowed 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.546 ' HA ' HD23 ' B' ' 27' ' ' LEU . 32.2 t 37.0 29.51 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 121.242 0.544 . . . . 0.0 110.042 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' B' ' 31' ' ' GLU . . . 74.79 51.78 7.66 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -63.49 -10.01 15.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.328 -1.101 . . . . 0.0 109.814 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -93.18 69.91 4.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.104 -0.998 . . . . 0.0 109.382 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.92 -42.16 1.49 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.459 ' O ' ' O ' ' B' ' 19' ' ' GLY . 1.1 m-20 -141.36 -153.3 0.45 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -1.174 . . . . 0.0 109.455 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.431 ' C ' ' OG ' ' B' ' 18' ' ' SER . 0.0 OUTLIER -176.75 43.13 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.541 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.47 ' N ' ' OG ' ' B' ' 18' ' ' SER . 0.7 OUTLIER -122.44 -16.61 7.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.264 -0.897 . . . . 0.0 109.688 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.07 170.21 7.61 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.263 -0.898 . . . . 0.0 109.349 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' B' ' 18' ' ' SER . 12.6 mt -84.94 137.96 32.79 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 2.0 ptmt -109.67 73.12 0.83 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.225 -0.922 . . . . 0.0 109.504 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.57 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.4 tttm 61.54 -85.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.4 -0.813 . . . . 0.0 110.037 179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 1.7 t -45.63 -39.43 7.75 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.134 -0.978 . . . . 0.0 109.88 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.532 ' HB3' HD22 ' B' ' 27' ' ' LEU . 3.2 mm-40 -47.96 -50.12 28.21 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.94 -1.1 . . . . 0.0 108.745 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.756 HD21 ' CE2' ' B' ' 76' ' ' PHE . 1.1 mt -59.14 -55.76 30.89 Favored 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.712 ' HD3' HG11 ' B' ' 53' ' ' VAL . 7.7 mttp -42.56 -33.82 0.76 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.436 -0.79 . . . . 0.0 109.595 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -71.7 -66.14 0.67 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.683 -179.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 1.002 HD21 HG13 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -41.98 -60.47 1.4 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.363 -0.835 . . . . 0.0 110.231 -179.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.832 HG22 HD22 ' B' ' 44' ' ' LEU . 80.7 mt -57.4 -53.55 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.326 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.643 HD21 HG21 ' B' ' 53' ' ' VAL . 0.7 OUTLIER -83.39 15.99 2.75 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.132 -0.98 . . . . 0.0 110.36 -179.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.527 ' N ' ' O ' ' B' ' 34' ' ' GLU . 22.6 t30 -135.7 4.28 3.06 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.531 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 4.7 mp0 -133.19 -37.31 0.98 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.101 -0.999 . . . . 0.0 109.49 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.977 HD22 ' CD1' ' B' ' 44' ' ' LEU . 5.4 mp -75.7 -54.71 6.53 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.15 -0.969 . . . . 0.0 109.407 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.441 ' HA ' ' HG2' ' B' ' 45' ' ' GLU . 0.7 OUTLIER 47.45 24.62 0.5 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.293 -0.88 . . . . 0.0 109.223 179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.17 -86.75 0.57 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.299 -0.876 . . . . 0.0 109.524 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -93.68 7.7 43.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.977 ' CD1' HD22 ' B' ' 40' ' ' LEU . 0.5 OUTLIER -109.29 -79.0 0.59 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.212 -0.93 . . . . 0.0 109.502 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' B' ' 46' ' ' GLU . 1.1 mm-40 44.32 90.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 109.335 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 2.2 mm-40 63.71 16.7 9.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.217 -0.927 . . . . 0.0 109.305 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.71 HD13 ' HB ' ' B' ' 53' ' ' VAL . 1.6 mt 56.54 109.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.887 . . . . 0.0 109.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.6 ptpt -43.35 -32.48 0.83 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.522 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.509 ' CG ' ' O ' ' B' ' 49' ' ' GLU . 4.0 pt-20 179.01 54.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.258 -0.901 . . . . 0.0 109.498 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.597 ' HA ' HG21 ' B' ' 47' ' ' ILE . 1.8 mt-30 48.45 53.8 11.46 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' B' ' 55' ' ' LYS . 0.5 OUTLIER -90.21 -70.09 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.285 -0.884 . . . . 0.0 109.798 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 1.025 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.9 t -86.49 -20.2 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 109.75 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.712 HG11 ' HD3' ' B' ' 33' ' ' LYS . 25.4 t -80.71 -36.92 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.056 -1.027 . . . . 0.0 108.892 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.538 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 36.6 t70 -81.6 -28.84 33.55 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.009 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 0.9 OUTLIER -77.66 -43.32 31.7 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.339 -0.85 . . . . 0.0 109.238 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.788 HG13 ' O ' ' B' ' 52' ' ' VAL . 15.8 m -57.04 -51.76 64.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.295 0 O-C-N 121.181 -0.949 . . . . 0.0 109.656 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.559 ' N ' HG23 ' B' ' 56' ' ' VAL . 1.7 tpt -40.19 -28.42 0.06 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.116 -0.99 . . . . 0.0 109.752 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' B' ' 56' ' ' VAL . 3.7 mt-10 -77.91 -48.4 16.45 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.065 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.48 ' O ' ' C ' ' B' ' 60' ' ' LEU . 38.8 m -74.55 -63.16 1.3 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.292 -0.88 . . . . 0.0 109.354 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 1.077 HD22 ' CD1' ' B' ' 76' ' ' PHE . 10.5 mt -34.95 -36.81 0.06 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 121.298 0.57 . . . . 0.0 110.128 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' B' ' 59' ' ' THR . 10.3 t70 -81.89 73.58 8.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 -87.57 -27.04 22.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.293 -0.88 . . . . 0.0 109.489 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -82.25 -51.5 7.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.902 . . . . 0.0 109.488 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.97 90.72 2.13 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -175.49 -35.96 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.252 -1.146 . . . . 0.0 108.595 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.62 38.46 2.22 Favored Glycine 0 N--CA 1.485 1.964 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NZ ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -153.63 108.06 3.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.315 -1.109 . . . . 0.0 109.493 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.545 ' HB3' ' CE2' ' B' ' 76' ' ' PHE . 75.1 m -69.64 156.06 39.54 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.342 -0.849 . . . . 0.0 109.898 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.455 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 8.5 m-20 -117.43 170.29 8.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.358 -0.839 . . . . 0.0 108.944 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.752 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -48.83 -67.43 0.27 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 111.319 -179.385 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.522 ' NE2' ' HG2' ' B' ' 72' ' ' GLU . 1.5 pp0? -44.21 -27.81 0.45 Allowed 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.21 -0.931 . . . . 0.0 108.955 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.612 ' O ' ' CD1' ' B' ' 76' ' ' PHE . 4.6 mt-10 -77.38 -43.2 33.6 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.407 -0.808 . . . . 0.0 109.809 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.879 ' HE1' HD22 ' B' ' 35' ' ' LEU . 12.6 t80 -49.15 -49.18 43.54 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.925 -1.11 . . . . 0.0 108.988 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.835 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 6.4 mtt -64.0 -41.31 97.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.437 -0.789 . . . . 0.0 109.381 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.605 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -66.42 -16.3 63.99 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.269 -0.894 . . . . 0.0 108.747 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 1.077 ' CD1' HD22 ' B' ' 60' ' ' LEU . 13.3 m-30 -75.5 -70.25 0.44 Allowed 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD12 ' A' ' 3' ' ' LEU . 39.4 t -52.64 -24.89 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.936 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -64.4 -48.04 76.91 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.37 -0.831 . . . . 0.0 109.36 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.681 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 67.0 mtp -74.74 -67.54 0.63 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.279 -0.888 . . . . 0.0 109.841 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 1.025 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.99 -23.44 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 120.435 -1.416 . . . . 0.0 109.704 -178.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.891 HG21 HD11 ' A' ' 11' ' ' ILE . 7.8 m -80.28 -68.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.906 -1.121 . . . . 0.0 108.795 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.563 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.5 t -77.65 -49.33 14.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.179 -0.951 . . . . 0.0 108.922 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.46 -37.1 0.18 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 121.261 0.553 . . . . 0.0 109.791 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 3.1 t -90.05 -35.34 15.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 0.0 109.505 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.484 ' O ' ' HG2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -65.79 -9.99 33.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' B' ' 89' ' ' GLU . 59.8 mt-10 -70.68 -21.06 62.63 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -76.97 -29.78 55.69 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.249 -0.907 . . . . 0.0 109.504 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -86.89 -30.65 21.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 109.484 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 85' ' ' HIS . 6.9 pt-20 -130.75 -169.1 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.205 -0.935 . . . . 0.0 109.495 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.472 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 27.5 t-80 74.0 121.51 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.513 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.482 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.838 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -70.22 -51.94 27.03 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.296 -0.878 . . . . 0.0 109.306 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.012 HD22 ' OE1' ' B' ' 39' ' ' GLU . 2.0 mp -72.41 -29.45 63.74 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.513 ' CD ' ' CZ ' ' B' ' 43' ' ' PHE . 1.2 tt0 -58.74 -64.5 0.91 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.197 -0.939 . . . . 0.0 109.312 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -43.57 98.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.208 -0.932 . . . . 0.0 109.265 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.648 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -68.41 -9.99 52.19 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.448 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.471 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -83.64 -52.71 6.22 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.917 . . . . 0.0 109.403 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.8 t -69.01 -20.36 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.32 -0.862 . . . . 0.0 109.444 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.515 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -83.59 -60.21 2.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.213 -0.93 . . . . 0.0 109.639 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.869 HD22 HD23 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -54.7 -38.46 67.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.591 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.741 HD11 HG21 ' B' ' 81' ' ' THR . 36.6 mt -68.17 -57.71 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.566 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -56.49 -19.05 13.52 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.277 -0.889 . . . . 0.0 109.46 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.896 HG11 HD21 ' B' ' 3' ' ' LEU . 0.8 OUTLIER -88.38 -29.9 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.138 -0.977 . . . . 0.0 109.253 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 73' ' ' PHE . 6.0 t80 -66.2 -41.4 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.051 -1.03 . . . . 0.0 109.075 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.658 ' CE1' ' CD2' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -78.46 -43.42 27.21 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.285 -0.884 . . . . 0.0 109.388 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.63 -55.65 20.95 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -0.925 . . . . 0.0 109.447 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.518 ' HE1' HG22 ' A' ' 13' ' ' VAL . 20.9 m-85 -60.4 -43.75 96.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 109.532 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.518 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 5.5 p -56.92 -22.12 35.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.273 -0.892 . . . . 0.0 109.47 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.467 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -71.23 -35.93 63.78 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 19' ' ' GLY . 42.0 mmm-85 -43.96 -47.14 8.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.317 -1.108 . . . . 0.0 109.464 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' A' ' 22' ' ' GLY . 3.4 tm-20 -70.42 154.67 41.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.461 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.23 -26.41 0.92 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.67 -149.8 0.18 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -174.26 65.6 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.275 -0.891 . . . . 0.0 109.425 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.658 ' CD2' ' CE1' ' A' ' 15' ' ' HIS . 7.3 m80 -169.28 -35.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.576 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' N ' ' HB2' ' A' ' 18' ' ' SER . 22.6 mtmt -129.34 159.6 35.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -0.906 . . . . 0.0 109.492 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.963 HD23 ' C ' ' A' ' 31' ' ' GLU . 7.3 mp -95.2 167.11 11.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 109.454 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -134.39 79.95 1.83 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.552 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.721 ' H ' HD13 ' A' ' 32' ' ' LEU . 4.1 ttmt 61.81 -85.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 110.3 179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.428 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 6.8 m -44.68 -49.65 10.3 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.208 -0.933 . . . . 0.0 110.435 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.963 ' C ' HD23 ' A' ' 27' ' ' LEU . 63.9 mm-40 -63.11 -34.46 77.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.029 -1.045 . . . . 0.0 109.716 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.113 HD23 HD13 ' A' ' 60' ' ' LEU . 1.9 mp -61.37 -70.19 0.2 Allowed 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.434 -0.791 . . . . 0.0 109.674 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 9.1 ttmt -42.43 -39.28 2.16 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.332 -0.855 . . . . 0.0 109.75 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -58.7 -56.64 19.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.8 HD21 HG13 ' A' ' 13' ' ' VAL . 0.1 OUTLIER -46.85 -35.27 6.16 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 109.476 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.803 HG22 HD13 ' A' ' 44' ' ' LEU . 1.2 mp -72.31 -39.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.592 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 33' ' ' LYS . 57.0 m-80 -78.66 -1.75 35.86 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.185 -0.947 . . . . 0.0 109.809 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.513 ' ND2' ' OH ' ' A' ' 17' ' ' TYR . 21.0 t-20 -107.45 -25.02 11.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.593 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.629 ' OE1' HD22 ' A' ' 40' ' ' LEU . 3.1 tm-20 -99.42 -44.97 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -0.929 . . . . 0.0 109.505 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.972 HD11 ' HA ' ' A' ' 81' ' ' THR . 3.6 mm? -56.11 -44.92 79.55 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.217 -0.927 . . . . 0.0 109.407 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.518 ' C ' ' CG ' ' A' ' 42' ' ' HIS . 0.4 OUTLIER 76.04 60.03 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.545 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.518 ' CG ' ' C ' ' A' ' 41' ' ' SER . 5.4 m-70 76.57 -1.43 2.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.263 -0.898 . . . . 0.0 109.657 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.771 ' HB3' HD12 ' A' ' 40' ' ' LEU . 1.7 t80 -60.11 -27.1 66.75 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.156 -0.965 . . . . 0.0 109.356 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.843 HD11 ' CB ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -113.49 -15.21 12.62 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.277 -0.889 . . . . 0.0 109.324 179.891 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 63.94 61.86 0.92 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.267 -0.896 . . . . 0.0 109.409 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.426 ' O ' ' C ' ' A' ' 47' ' ' ILE . 33.0 tt0 46.38 83.41 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.91 . . . . 0.0 109.385 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.761 HD13 HG21 ' A' ' 53' ' ' VAL . 3.9 mp -43.71 143.69 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.293 -0.879 . . . . 0.0 109.469 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 pttt -149.57 -48.7 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.474 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.489 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 87.9 mt-10 -64.81 -10.84 31.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.365 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 0.8 OUTLIER 75.29 54.28 0.07 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.292 -0.88 . . . . 0.0 109.448 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.83 -70.4 0.68 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.251 -0.906 . . . . 0.0 109.606 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.914 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.2 t -92.03 -24.78 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.112 -0.993 . . . . 0.0 109.251 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.761 HG21 HD13 ' A' ' 47' ' ' ILE . 39.2 t -78.58 -18.57 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.355 -0.841 . . . . 0.0 109.36 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.496 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.6 t0 -87.69 -37.67 16.5 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.239 -0.913 . . . . 0.0 109.44 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -78.81 -39.21 36.26 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.782 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.0 m -65.08 -46.16 92.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -43.51 -25.74 0.17 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.117 -0.989 . . . . 0.0 110.144 -179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.8 OUTLIER -86.39 -47.15 9.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.074 -1.016 . . . . 0.0 109.892 -179.632 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 1.01 HG21 ' HE3' ' A' ' 79' ' ' MET . 7.2 t -68.98 -9.76 53.92 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.226 -0.921 . . . . 0.0 109.828 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.113 HD13 HD23 ' A' ' 32' ' ' LEU . 6.7 mt -94.4 -68.57 0.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.504 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 57' ' ' MET . 49.7 p-10 -65.03 87.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.495 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -82.94 -9.34 59.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.15 -22.43 16.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.235 -0.916 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 79.9 69.14 1.42 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 26.6 t70 178.36 32.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.287 -1.125 . . . . 0.0 108.374 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.43 64.89 3.08 Favored Glycine 0 N--CA 1.482 1.721 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' LYS . 6.0 mt-10 -143.9 84.81 1.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.317 -1.108 . . . . 0.0 109.395 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' N ' ' A' ' 69' ' ' ASP . 16.0 t -69.95 157.08 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 109.724 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.84 171.85 7.78 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 179.753 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.33 -51.35 70.3 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.248 -0.907 . . . . 0.0 110.412 -179.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 72' ' ' GLU . 17.6 pt20 -57.27 -40.32 77.46 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.229 -0.92 . . . . 0.0 108.802 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mt-10 -77.36 -16.17 59.02 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.467 -0.77 . . . . 0.0 109.349 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.685 ' CD1' ' CD1' ' A' ' 14' ' ' PHE . 56.9 t80 -70.38 -64.19 0.94 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.929 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 2.7 tpp -58.11 -43.38 87.13 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.2 -28.03 69.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.439 -0.788 . . . . 0.0 109.126 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.62 ' CZ ' ' CD1' ' A' ' 36' ' ' ILE . 1.0 OUTLIER -62.34 -69.8 0.24 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.295 -0.878 . . . . 0.0 108.797 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.524 ' O ' ' CB ' ' A' ' 81' ' ' THR . 41.3 t -57.07 -22.78 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.975 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -57.69 -52.76 64.1 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.508 -0.745 . . . . 0.0 109.418 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 1.01 ' HE3' HG21 ' A' ' 59' ' ' THR . 0.7 OUTLIER -73.94 -63.26 1.25 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.436 -0.79 . . . . 0.0 109.923 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.914 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -47.88 -22.14 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 O-C-N 120.314 -1.492 . . . . 0.0 109.378 -179.14 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.972 ' HA ' HD11 ' A' ' 40' ' ' LEU . 4.5 m -79.1 -67.77 0.72 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.01 -1.056 . . . . 0.0 108.863 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.57 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -79.43 -49.43 12.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.135 -0.978 . . . . 0.0 108.837 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.85 -34.88 0.12 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.678 -0.639 . . . . 0.0 109.694 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.404 ' N ' ' O ' ' A' ' 82' ' ' THR . 30.7 t -82.31 -46.13 14.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.493 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -47.03 -25.11 0.75 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.232 -0.918 . . . . 0.0 109.49 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -76.55 -50.7 13.26 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.3 -0.875 . . . . 0.0 109.508 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.74 -18.96 64.57 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.183 -0.948 . . . . 0.0 109.54 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -46.34 -63.28 1.04 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.27 -0.894 . . . . 0.0 109.496 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 4.1 pt-20 -56.35 168.64 0.52 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 109.471 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.451 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 39.8 m-70 60.82 177.62 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.293 -0.879 . . . . 0.0 109.506 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.495 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.515 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -64.37 -78.66 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.894 . . . . 0.0 109.769 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.896 HD21 HG11 ' A' ' 13' ' ' VAL . 90.0 mt -63.01 -25.24 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.126 -0.983 . . . . 0.0 109.892 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.52 ' O ' ' CG ' ' B' ' 7' ' ' MET . 1.0 OUTLIER -69.8 -70.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.127 -0.983 . . . . 0.0 109.537 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 13.6 tttt -60.28 -17.7 44.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 109.466 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.704 ' HB1' HD23 ' A' ' 10' ' ' LEU . . . -85.79 -26.81 25.57 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -0.921 . . . . 0.0 109.765 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.546 ' O ' HD12 ' B' ' 11' ' ' ILE . 3.4 ptt? -78.87 -31.74 45.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.128 -0.983 . . . . 0.0 109.474 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.521 ' N ' ' HG3' ' B' ' 7' ' ' MET . 56.0 t -82.39 -39.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.202 -0.936 . . . . 0.0 109.386 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.838 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -66.85 -42.95 84.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.24 -0.913 . . . . 0.0 109.41 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.584 HD13 ' HB1' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -68.65 -62.56 1.33 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.671 HG23 ' HZ ' ' B' ' 70' ' ' PHE . 85.7 mt -44.98 -41.75 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.181 -0.95 . . . . 0.0 109.209 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.515 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 23.0 t0 -58.83 -61.81 2.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.311 -0.868 . . . . 0.0 109.364 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.929 HG13 HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.54 -25.45 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.337 -0.852 . . . . 0.0 109.434 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' O ' ' B' ' 25' ' ' HIS . 4.3 t80 -72.32 -49.69 32.54 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.927 -1.108 . . . . 0.0 109.344 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -75.91 -9.99 59.06 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 110.013 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.515 ' CG ' ' O ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -90.2 -61.69 1.63 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.047 -1.033 . . . . 0.0 109.319 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.586 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 34.2 m-85 -57.98 -43.77 86.71 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.573 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.701 ' N ' HD21 ' B' ' 27' ' ' LEU . 2.7 p -74.64 -14.01 60.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.508 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.545 ' CA ' ' HG2' ' B' ' 24' ' ' LYS . . . -92.54 8.98 76.65 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.502 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 54.7 mtp85 -87.81 -59.88 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -1.15 . . . . 0.0 109.396 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.2 OUTLIER -80.33 170.11 16.83 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.298 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' B' ' 23' ' ' ASP . . . -52.01 89.46 0.01 OUTLIER Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' B' ' 22' ' ' GLY . 0.5 OUTLIER 162.39 -164.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -1.084 . . . . 0.0 109.365 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.545 ' HG2' ' CA ' ' B' ' 19' ' ' GLY . 0.0 OUTLIER 171.05 58.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.236 -0.915 . . . . 0.0 109.458 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 16.5 t60 -170.27 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.302 -0.874 . . . . 0.0 109.643 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.551 ' CE ' ' HB3' ' B' ' 67' ' ' GLU . 1.4 ptmt -127.03 166.03 18.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.202 -0.936 . . . . 0.0 109.574 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.701 HD21 ' N ' ' B' ' 18' ' ' SER . 20.7 mt -121.16 130.62 53.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.265 -0.897 . . . . 0.0 109.859 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' B' ' 29' ' ' LYS . 5.0 ttpt -69.6 155.54 40.33 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 28' ' ' LYS . 0.2 OUTLIER -39.98 -38.68 0.74 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.185 -0.947 . . . . 0.0 109.732 -179.464 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -68.33 -46.15 71.01 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.324 -0.86 . . . . 0.0 109.582 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.525 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.3 OUTLIER -53.03 -44.62 67.5 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.021 -1.049 . . . . 0.0 108.352 179.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.702 ' CD1' HD22 ' B' ' 60' ' ' LEU . 3.6 mm? -51.78 -70.71 0.08 Allowed 'General case' 0 C--N 1.297 -1.697 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.615 ' HE3' HG21 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -37.28 -33.11 0.05 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.731 -0.606 . . . . 0.0 110.146 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.448 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -69.84 -61.03 1.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.137 -0.977 . . . . 0.0 109.635 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.929 HD11 HG13 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -53.04 -20.6 3.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.332 -0.855 . . . . 0.0 110.052 -179.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 1.055 HD12 HG22 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -82.42 -49.06 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.047 -1.033 . . . . 0.0 109.391 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.77 0.05 19.31 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.182 -0.949 . . . . 0.0 109.462 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.455 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 0.6 OUTLIER -118.73 -22.33 7.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.163 -0.96 . . . . 0.0 109.576 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 1.012 ' OE1' HD22 ' A' ' 3' ' ' LEU . 18.5 pt-20 -91.59 -45.07 8.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 1.0 HD22 ' CG ' ' B' ' 39' ' ' GLU . 0.8 OUTLIER -84.19 -50.6 7.75 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 108.616 179.348 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.472 ' O ' ' CB ' ' B' ' 42' ' ' HIS . 0.0 OUTLIER 52.1 65.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.591 -0.693 . . . . 0.0 109.657 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.472 ' CB ' ' O ' ' B' ' 41' ' ' SER . 0.0 OUTLIER 74.43 -0.01 3.46 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.304 -0.872 . . . . 0.0 109.647 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 40' ' ' LEU . 1.2 m-85 -57.91 -36.1 71.98 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.047 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.858 HD21 ' HG ' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -124.02 -22.07 4.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.357 -0.84 . . . . 0.0 109.64 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' B' ' 44' ' ' LEU . 13.0 pt-20 39.68 65.44 0.71 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.393 -0.817 . . . . 0.0 109.76 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.808 ' OE2' HG12 ' B' ' 80' ' ' VAL . 0.2 OUTLIER -129.14 -18.5 3.68 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.309 -179.453 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 1.006 HD13 HG23 ' B' ' 53' ' ' VAL . 12.0 mt -81.81 72.67 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 120.973 -1.079 . . . . 0.0 110.048 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' B' ' 49' ' ' GLU . 5.2 pttt -44.85 -27.38 0.51 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.215 -0.928 . . . . 0.0 108.819 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' B' ' 48' ' ' LYS . 10.5 pt-20 178.08 -32.23 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.494 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -165.05 28.02 0.06 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.388 -0.82 . . . . 0.0 109.251 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -69.16 -70.77 0.25 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.43 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 1.018 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -91.03 -9.89 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.11 -0.994 . . . . 0.0 109.009 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.055 HG22 HD12 ' B' ' 36' ' ' ILE . 10.6 t -84.85 -29.67 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.494 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 17.9 t0 -90.15 -28.88 18.64 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -84.93 -49.81 8.03 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.442 -0.786 . . . . 0.0 109.105 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.77 ' O ' HD12 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -63.06 -41.52 93.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.132 -0.98 . . . . 0.0 108.754 179.578 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.496 ' HB2' ' O ' ' B' ' 53' ' ' VAL . 0.9 OUTLIER -43.06 -46.09 5.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.481 -0.762 . . . . 0.0 109.238 179.605 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -60.66 -48.25 82.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.227 -0.92 . . . . 0.0 109.009 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.4 ' O ' ' OE1' ' B' ' 72' ' ' GLU . 4.0 m -64.36 -13.95 53.55 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.352 -0.843 . . . . 0.0 109.196 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.788 HD21 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mp -92.25 -81.41 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.336 -0.853 . . . . 0.0 109.494 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.461 ' HA ' ' O ' ' B' ' 67' ' ' GLU . 46.1 p-10 -59.17 89.17 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' B' ' 60' ' ' LEU . 0.2 OUTLIER -103.01 -1.66 28.9 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.621 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.434 ' HB2' ' OE2' ' B' ' 67' ' ' GLU . 0.7 OUTLIER -81.54 -9.34 59.71 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.118 -0.989 . . . . 0.0 109.488 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.39 81.85 0.43 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.72 -32.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.242 -1.152 . . . . 0.0 108.635 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.08 37.34 1.84 Allowed Glycine 0 N--CA 1.486 1.981 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.551 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -129.61 149.25 51.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.258 -1.142 . . . . 0.0 109.467 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 10.2 t -95.58 155.61 16.67 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.699 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' B' ' 72' ' ' GLU . 17.2 t70 -121.39 171.18 8.95 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.671 ' HZ ' HG23 ' B' ' 11' ' ' ILE . 0.1 OUTLIER -60.26 -54.29 47.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.135 -0.978 . . . . 0.0 110.334 -179.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.779 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 1.9 pt20 -56.55 -21.72 28.32 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.086 -1.009 . . . . 0.0 108.815 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' B' ' 76' ' ' PHE . 14.9 mm-40 -84.61 -30.46 24.94 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.559 -0.713 . . . . 0.0 109.159 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.736 ' CZ ' HD21 ' A' ' 3' ' ' LEU . 37.1 t80 -62.85 -47.03 85.14 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.407 -0.808 . . . . 0.0 109.083 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.975 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 3.1 mtt -70.33 -56.63 6.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.348 -0.845 . . . . 0.0 109.301 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 1.013 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.43 -16.08 21.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 108.928 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.788 ' HB2' HD21 ' B' ' 60' ' ' LEU . 2.5 t80 -72.49 -68.99 0.43 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.512 -0.742 . . . . 0.0 109.137 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.634 HG21 HD23 ' A' ' 3' ' ' LEU . 42.7 t -56.1 -27.92 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.259 -0.901 . . . . 0.0 109.162 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.929 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.16 -36.46 81.85 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.378 -0.826 . . . . 0.0 109.5 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.624 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.0 OUTLIER -77.08 -68.16 0.64 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 109.557 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 1.018 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.41 -24.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 O-C-N 120.606 -1.309 . . . . 0.0 109.068 -179.477 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.741 HG21 HD11 ' A' ' 11' ' ' ILE . 8.8 m -76.77 -69.19 0.53 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.142 -0.974 . . . . 0.0 109.395 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.4 t -75.34 -49.55 18.76 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.04 -1.037 . . . . 0.0 108.922 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.38 -30.33 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.761 -0.587 . . . . 0.0 109.775 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.501 ' N ' ' O ' ' B' ' 82' ' ' THR . 15.7 t -81.4 -46.65 14.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.304 -0.872 . . . . 0.0 109.604 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.574 ' O ' ' CD1' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -67.36 -9.85 45.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.426 ' O ' ' O ' ' B' ' 89' ' ' GLU . 4.1 mm-40 -83.99 -15.78 46.44 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 109.598 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -30.84 71.87 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.892 . . . . 0.0 109.605 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' B' ' 85' ' ' HIS . 0.6 OUTLIER -47.78 -26.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.234 -0.917 . . . . 0.0 109.557 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' B' ' 90' ' ' HIS . 3.3 tp10 -157.34 150.59 23.74 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 109.422 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.451 ' N ' ' HG3' ' B' ' 89' ' ' GLU . 58.9 t-80 -116.16 169.18 9.47 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.428 ' OXT' ' HG3' ' B' ' 91' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 117.965 -1.017 . . . . 0.0 109.486 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.277 0.56 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.763 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 2.9 mm-40 -68.76 -48.94 62.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.241 -0.912 . . . . 0.0 109.272 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.915 HD11 HD21 ' B' ' 35' ' ' LEU . 5.5 mt -78.99 -23.3 44.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.31 -0.869 . . . . 0.0 109.423 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.71 -61.99 2.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.127 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.44 -41.72 96.4 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.292 -0.88 . . . . 0.0 109.183 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.526 ' HB2' ' HA ' ' B' ' 6' ' ' ALA . . . -70.94 -10.77 60.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.385 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.614 ' CE ' HD13 ' B' ' 40' ' ' LEU . 2.7 mtp -82.07 -54.84 4.97 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.197 -0.939 . . . . 0.0 109.289 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.503 ' HA ' HD12 ' A' ' 11' ' ' ILE . 31.5 t -62.21 -32.76 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.328 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.91 ' HB1' ' HG2' ' B' ' 2' ' ' GLU . . . -73.17 -65.9 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.272 -0.892 . . . . 0.0 109.527 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.707 ' CD2' HD23 ' B' ' 3' ' ' LEU . 4.7 mt -44.47 -34.53 2.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.207 -0.933 . . . . 0.0 109.335 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.503 HD12 ' HA ' ' A' ' 8' ' ' VAL . 54.6 mt -63.39 -52.24 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.921 . . . . 0.0 109.361 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.53 -19.81 40.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.229 -0.919 . . . . 0.0 109.222 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.91 HG11 HD21 ' B' ' 3' ' ' LEU . 1.3 t -83.4 -29.78 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.338 -0.851 . . . . 0.0 109.333 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 46.7 t80 -70.5 -42.71 70.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 120.918 -1.114 . . . . 0.0 109.138 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.33 -34.12 36.93 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.31 -0.869 . . . . 0.0 109.492 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -67.21 -62.13 1.58 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.206 -0.934 . . . . 0.0 109.445 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.575 ' CD2' ' HG ' ' A' ' 35' ' ' LEU . 28.2 m-85 -56.6 -47.22 80.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.304 -0.873 . . . . 0.0 109.413 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.523 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 4.6 p -70.0 -17.56 63.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.478 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -91.26 15.31 61.47 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 7.1 mmt85 -89.61 -43.19 10.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.25 -1.147 . . . . 0.0 109.483 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 20' ' ' ARG . 7.0 mt-10 -164.9 119.73 1.35 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.252 -0.905 . . . . 0.0 109.47 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.545 ' HA3' ' HZ1' ' A' ' 26' ' ' LYS . . . 143.12 -117.3 1.09 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 22.4 m-20 -115.48 -2.99 12.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.227 -1.161 . . . . 0.0 109.671 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 23' ' ' ASP . 0.6 OUTLIER 76.25 17.7 2.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 109.502 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -142.04 10.82 1.97 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 109.482 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.545 ' HZ1' ' HA3' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -170.14 167.36 8.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.196 -0.94 . . . . 0.0 109.499 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.94 HD23 ' C ' ' A' ' 31' ' ' GLU . 6.3 mp -100.31 164.78 11.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.209 -0.932 . . . . 0.0 109.442 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 1.7 ptmm? -128.4 74.85 1.58 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.25 -0.906 . . . . 0.0 109.479 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 32' ' ' LEU . 11.4 ttmt 61.83 -85.57 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.395 -0.816 . . . . 0.0 110.206 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.47 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -44.8 -48.41 10.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.94 ' C ' HD23 ' A' ' 27' ' ' LEU . 78.5 mm-40 -56.02 -40.55 73.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 109.302 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.831 HD22 HD23 ' A' ' 60' ' ' LEU . 38.8 mt -60.06 -69.97 0.19 Allowed 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.633 -0.667 . . . . 0.0 109.571 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.471 ' HG2' ' OD1' ' A' ' 37' ' ' ASN . 14.2 ttmt -42.54 -27.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.318 -0.864 . . . . 0.0 109.729 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' N ' ' OE1' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -66.54 -54.32 25.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 109.469 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.879 HD21 HG13 ' A' ' 13' ' ' VAL . 16.1 mt -53.49 -37.49 62.78 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.676 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.084 HD11 ' CE2' ' A' ' 76' ' ' PHE . 3.1 mm -69.0 -38.7 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.553 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' OD1' ' HG2' ' A' ' 33' ' ' LYS . 7.2 m120 -82.88 -6.63 59.54 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 109.661 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.422 ' CG ' ' OH ' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -99.69 -18.24 17.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.514 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.703 ' OE1' HG13 ' A' ' 77' ' ' VAL . 19.6 tt0 -111.04 -57.57 2.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.229 -0.919 . . . . 0.0 109.544 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.674 ' H ' HD12 ' A' ' 40' ' ' LEU . 6.3 mp -65.5 -53.69 38.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.267 -0.896 . . . . 0.0 109.52 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER 162.84 -86.82 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.336 -0.853 . . . . 0.0 109.329 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 1.9 m-70 -141.31 -41.85 0.38 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.278 -0.889 . . . . 0.0 109.368 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.519 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -158.45 21.7 0.23 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.284 -0.885 . . . . 0.0 109.526 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.993 HD21 HD12 ' A' ' 47' ' ' ILE . 0.1 OUTLIER 36.04 -93.58 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.698 -0.626 . . . . 0.0 110.167 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -95.32 -83.16 0.36 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.168 -0.957 . . . . 0.0 109.653 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -132.71 41.42 3.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.206 -0.934 . . . . 0.0 109.408 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.993 HD12 HD21 ' A' ' 44' ' ' LEU . 1.6 mt -58.26 -50.88 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.42 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER -40.78 -25.81 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.434 -0.791 . . . . 0.0 109.678 -179.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -95.64 41.7 1.1 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.211 179.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 10.0 mt-30 45.9 48.12 12.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -0.899 . . . . 0.0 109.515 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -90.14 -70.46 0.67 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.288 -0.883 . . . . 0.0 109.536 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.926 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.7 t -92.37 -15.58 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.199 -0.938 . . . . 0.0 109.168 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.676 HG23 HG23 ' A' ' 47' ' ' ILE . 42.5 t -81.71 -23.57 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 108.896 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 1.1 t0 -86.19 -30.26 22.56 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.32 -0.862 . . . . 0.0 109.085 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -82.65 -46.15 13.61 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.37 -0.831 . . . . 0.0 109.217 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.784 HG22 ' O ' ' A' ' 52' ' ' VAL . 35.3 m -58.37 -43.79 87.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.181 -0.949 . . . . 0.0 109.544 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.563 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.2 -28.47 3.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.086 -1.009 . . . . 0.0 109.99 -179.766 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 59' ' ' THR . 1.2 pp20? -82.58 -34.64 27.65 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.043 -1.036 . . . . 0.0 109.719 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.524 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 16.9 m -78.31 -64.84 1.07 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.177 -0.952 . . . . 0.0 109.267 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.092 HD21 ' CG ' ' A' ' 76' ' ' PHE . 8.8 mp -39.41 -31.6 0.09 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.608 -0.682 . . . . 0.0 109.791 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 59' ' ' THR . 0.4 OUTLIER -43.96 105.84 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 61' ' ' ASP . 18.9 t-20 -44.93 -48.53 11.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.237 -0.914 . . . . 0.0 109.435 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -178.61 31.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.245 -0.91 . . . . 0.0 109.575 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.02 90.78 1.54 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -175.82 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.286 -1.126 . . . . 0.0 108.509 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.24 27.21 6.62 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.534 ' HB2' ' CG ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -138.13 119.07 14.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.256 -1.143 . . . . 0.0 109.43 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.0 t -69.89 158.61 35.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.215 -0.928 . . . . 0.0 109.782 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.543 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.2 OUTLIER -117.75 172.12 7.58 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.669 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 1.5 t80 -60.16 -56.2 24.51 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.885 . . . . 0.0 110.585 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.842 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 1.6 mp0 -57.27 -31.18 65.34 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.886 . . . . 0.0 109.275 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.543 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 0.1 OUTLIER -79.18 -23.9 43.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.392 -0.817 . . . . 0.0 108.986 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.817 ' CE1' HD13 ' A' ' 35' ' ' LEU . 1.9 t80 -65.34 -58.04 6.9 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.416 -0.802 . . . . 0.0 108.952 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.24 -41.57 93.44 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.26 -0.9 . . . . 0.0 109.028 179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -63.44 -26.07 68.56 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.131 -0.981 . . . . 0.0 109.081 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 1.092 ' CG ' HD21 ' A' ' 60' ' ' LEU . 2.1 t80 -67.79 -63.59 1.03 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.352 -0.843 . . . . 0.0 109.31 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.703 HG13 ' OE1' ' A' ' 39' ' ' GLU . 25.3 t -58.9 -25.42 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.315 -0.866 . . . . 0.0 108.963 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.856 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -68.27 -33.4 74.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.43 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.6 OUTLIER -81.7 -68.11 0.72 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 109.212 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.926 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -49.08 -21.01 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.059 0 O-C-N 120.546 -1.346 . . . . 0.0 110.114 -178.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.578 HG23 ' N ' ' A' ' 82' ' ' THR . 5.8 t -87.61 -49.73 6.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.675 -1.265 . . . . 0.0 108.901 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.584 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.1 m -90.57 -56.39 3.22 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -33.73 -34.16 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.313 0.578 . . . . 0.0 109.913 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.51 ' N ' ' O ' ' A' ' 82' ' ' THR . 41.0 t -79.03 -50.17 11.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.227 -0.921 . . . . 0.0 109.529 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.421 ' N ' ' O ' ' A' ' 82' ' ' THR . 0.0 OUTLIER -53.78 -56.74 14.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.263 -0.898 . . . . 0.0 109.512 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.438 ' O ' ' OXT' ' A' ' 91' ' ' GLU . 2.4 pt-20 -60.94 -19.76 61.22 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.562 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -81.63 -26.61 34.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -77.49 -70.04 0.5 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.237 -0.914 . . . . 0.0 109.482 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 2.7 pt-20 -111.8 168.02 9.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.243 -0.91 . . . . 0.0 109.5 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.443 ' HB2' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER 71.44 43.22 0.63 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.52 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.438 ' OXT' ' O ' ' A' ' 86' ' ' GLU . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.431 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.91 ' HG2' ' HB1' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -63.86 -72.2 0.15 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.587 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.91 HD21 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -62.33 -23.13 66.59 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.335 -0.853 . . . . 0.0 109.696 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.404 ' HB2' ' CB ' ' B' ' 1' ' ' SER . 4.0 tt0 -62.56 -62.2 1.91 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.443 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.28 -26.82 68.61 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.208 -0.933 . . . . 0.0 109.27 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -74.93 -23.6 58.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 109.429 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -37.75 36.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.266 -0.896 . . . . 0.0 109.466 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.46 ' O ' HG22 ' B' ' 11' ' ' ILE . 74.8 t -71.07 -35.61 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.26 -0.9 . . . . 0.0 109.642 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -78.21 -56.66 4.29 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.184 -0.948 . . . . 0.0 109.564 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.771 HD23 HD22 ' A' ' 3' ' ' LEU . 3.5 mt -54.29 -47.03 72.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 109.595 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.828 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -58.22 -46.89 88.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.137 -0.977 . . . . 0.0 109.425 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.571 ' N ' HG23 ' B' ' 11' ' ' ILE . 2.6 m-20 -58.91 -22.74 60.24 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.138 -0.976 . . . . 0.0 109.492 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.845 HG11 HD11 ' A' ' 3' ' ' LEU . 1.1 t -85.56 -29.98 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.504 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 49.3 t80 -66.5 -42.24 87.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.798 -1.189 . . . . 0.0 109.246 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -76.83 -41.32 44.7 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -0.917 . . . . 0.0 109.534 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.62 -65.91 0.62 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.252 -0.905 . . . . 0.0 109.516 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.587 ' CD1' HG13 ' B' ' 13' ' ' VAL . 33.0 m-85 -50.75 -41.7 56.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 109.379 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.53 ' HB3' ' N ' ' B' ' 26' ' ' LYS . 1.4 m -88.32 43.05 1.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.276 -0.89 . . . . 0.0 109.468 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -104.14 -61.05 0.67 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.519 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -50.96 -20.62 1.41 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.377 -1.072 . . . . 0.0 110.005 -179.604 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' B' ' 28' ' ' LYS . 4.5 tm-20 -69.68 155.14 40.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.087 -1.008 . . . . 0.0 109.421 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.453 ' O ' ' O ' ' B' ' 21' ' ' GLU . . . -43.2 -91.79 0.01 OUTLIER Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.306 -1.518 . . . . 0.0 109.306 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.531 ' O ' ' N ' ' B' ' 25' ' ' HIS . 1.5 m-20 -68.31 86.99 0.29 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.223 -1.163 . . . . 0.0 108.948 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' B' ' 18' ' ' SER . 8.6 pttp -41.97 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.451 -0.781 . . . . 0.0 109.829 -179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 23' ' ' ASP . 1.0 OUTLIER -170.46 -35.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.244 -0.91 . . . . 0.0 109.706 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.539 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -128.25 164.63 22.15 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.766 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.7 HD22 HD23 ' B' ' 32' ' ' LEU . 7.5 mp -90.56 164.55 14.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.34 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -131.32 74.35 1.59 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.325 -0.86 . . . . 0.0 109.346 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER 63.54 -83.21 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.607 -0.683 . . . . 0.0 110.363 179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.465 ' O ' ' OE1' ' B' ' 34' ' ' GLU . 1.4 t -45.02 -44.55 10.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.147 -0.97 . . . . 0.0 110.591 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.678 ' C ' HD23 ' B' ' 27' ' ' LEU . 19.9 mm-40 -61.87 -39.32 91.5 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.76 -1.213 . . . . 0.0 108.718 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.7 HD23 HD22 ' B' ' 27' ' ' LEU . 28.9 mt -55.35 -70.31 0.11 Allowed 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 1.03 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -44.45 -28.12 0.53 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.885 . . . . 0.0 109.731 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' B' ' 38' ' ' ASN . 0.0 OUTLIER -67.72 -68.36 0.39 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.126 -0.984 . . . . 0.0 109.558 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.915 HD21 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -41.72 -49.32 4.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.389 -0.819 . . . . 0.0 109.862 -179.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.614 HD12 HG21 ' B' ' 80' ' ' VAL . 6.4 mm -56.0 -58.79 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.155 -0.965 . . . . 0.0 109.567 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.523 ' OD1' ' CG1' ' B' ' 47' ' ' ILE . 0.7 OUTLIER -85.06 15.19 4.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.314 -0.866 . . . . 0.0 109.844 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.509 ' N ' ' O ' ' B' ' 34' ' ' GLU . 5.2 m-20 -116.63 -8.97 11.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.161 -0.962 . . . . 0.0 109.473 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.527 ' HG2' ' CG ' ' A' ' 3' ' ' LEU . 12.5 mp0 -133.78 -44.38 0.81 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 1.007 HD12 HD21 ' B' ' 44' ' ' LEU . 3.8 mm? -56.49 -62.7 1.55 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.212 -0.93 . . . . 0.0 109.202 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER 80.58 -70.57 0.08 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.699 . . . . 0.0 110.62 179.25 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.86 -1.81 1.38 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.8 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.677 ' HB3' HD23 ' B' ' 44' ' ' LEU . 5.3 t80 -61.82 -13.97 28.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.801 -1.187 . . . . 0.0 108.835 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 1.007 HD21 HD12 ' B' ' 40' ' ' LEU . 0.1 OUTLIER -136.81 12.26 3.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.384 -0.823 . . . . 0.0 109.165 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 46' ' ' GLU . 4.1 mt-10 64.15 38.29 8.38 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.219 -0.925 . . . . 0.0 109.375 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 45' ' ' GLU . 1.8 mt-10 51.53 176.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 109.376 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.809 HG13 HG21 ' B' ' 53' ' ' VAL . 1.5 mm -85.56 87.39 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.39 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.485 ' CE ' ' OE2' ' B' ' 51' ' ' GLU . 0.0 OUTLIER -43.38 -48.2 6.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.478 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -158.51 58.09 0.45 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.231 -0.918 . . . . 0.0 109.278 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.543 ' N ' HG22 ' B' ' 47' ' ' ILE . 0.0 OUTLIER 62.35 36.23 14.58 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.257 -0.902 . . . . 0.0 109.294 -179.856 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' B' ' 48' ' ' LYS . 3.1 tt0 -65.18 -70.14 0.25 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.338 -0.851 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.924 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.5 t -88.57 -15.67 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.221 -0.925 . . . . 0.0 109.414 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.03 HG11 ' HG3' ' B' ' 33' ' ' LYS . 52.3 t -78.93 -30.38 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.087 -1.008 . . . . 0.0 108.927 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' HB3' ' B' ' 50' ' ' GLN . 21.0 t0 -82.82 -36.86 25.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.291 -0.881 . . . . 0.0 109.069 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -72.01 -47.43 51.98 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 0.0 109.208 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.861 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 33.9 m -59.84 -45.73 94.55 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 O-C-N 121.252 -0.905 . . . . 0.0 109.391 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.592 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.22 -24.83 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.878 -1.139 . . . . 0.0 109.977 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.8 tt0 -88.29 -45.86 9.69 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.11 -0.993 . . . . 0.0 110.377 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.758 HG21 ' SD ' ' B' ' 79' ' ' MET . 8.5 t -69.82 -52.91 21.0 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.913 -1.117 . . . . 0.0 110.003 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.751 HD21 ' CG ' ' B' ' 76' ' ' PHE . 5.6 mt -44.81 -65.27 0.55 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.986 -1.071 . . . . 0.0 109.093 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -45.55 102.61 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 109.496 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.54 11.06 7.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.431 ' OD1' ' HB2' ' B' ' 65' ' ' ASP . 3.4 p30 -111.39 -13.69 13.86 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 109.438 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.89 77.34 1.0 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.431 ' HB2' ' OD1' ' B' ' 63' ' ' ASP . 0.4 OUTLIER 178.14 -33.24 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.222 -1.163 . . . . 0.0 108.632 -179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.19 4.66 29.04 Favored Glycine 0 N--CA 1.486 1.972 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.491 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 2.3 mm-40 -98.15 137.81 36.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -1.177 . . . . 0.0 109.446 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 15.5 t -79.33 159.21 27.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.169 -0.957 . . . . 0.0 109.639 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.503 ' CB ' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -125.69 171.51 10.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.378 -0.826 . . . . 0.0 108.82 179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.619 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.8 OUTLIER -58.03 -53.31 59.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.224 -0.923 . . . . 0.0 110.27 -179.671 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.642 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 8.5 mt-30 -58.16 -30.36 66.32 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.358 -0.839 . . . . 0.0 109.025 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.503 ' HG3' ' CB ' ' B' ' 69' ' ' ASP . 6.2 mt-10 -80.44 -22.02 41.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.433 -0.792 . . . . 0.0 109.278 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.478 ' HB2' ' CD1' ' B' ' 14' ' ' PHE . 2.8 t80 -69.26 -61.77 1.65 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.286 -0.884 . . . . 0.0 108.795 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.856 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -57.9 -42.51 84.85 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 179.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -61.85 -28.79 69.74 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.861 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.7 OUTLIER -64.31 -69.64 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.442 -0.786 . . . . 0.0 108.985 179.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.481 ' O ' ' CB ' ' B' ' 81' ' ' THR . 43.1 t -51.93 -26.55 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.307 -0.87 . . . . 0.0 108.804 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -65.93 -42.97 89.4 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.37 -0.831 . . . . 0.0 109.432 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.758 ' SD ' HG21 ' B' ' 59' ' ' THR . 26.2 mtm -77.89 -69.56 0.54 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.266 -0.896 . . . . 0.0 109.568 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.924 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.69 -24.15 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 O-C-N 120.683 -1.261 . . . . 0.0 110.026 -178.795 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.481 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 23.0 m -82.52 -65.69 0.98 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.854 -1.154 . . . . 0.0 108.594 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.1 m -75.59 -54.58 6.77 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -34.89 -46.74 0.32 Allowed 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.213 0.53 . . . . 0.0 110.186 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.462 ' SG ' ' HA ' ' B' ' 44' ' ' LEU . 54.0 t -64.71 -49.74 69.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.213 -0.929 . . . . 0.0 109.585 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -16.88 35.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.892 . . . . 0.0 109.548 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -90.1 -27.02 19.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.926 . . . . 0.0 109.504 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -80.94 -31.95 34.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.546 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -45.68 -57.27 4.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 109.469 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.8 97.82 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.257 -0.902 . . . . 0.0 109.49 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -92.38 125.04 36.87 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.508 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.491 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.773 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 3.8 mm-40 -69.71 -60.87 2.04 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.307 -0.871 . . . . 0.0 109.438 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.989 HD23 HG21 ' B' ' 77' ' ' VAL . 5.9 mp -66.32 -21.67 66.26 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.293 -0.88 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 25.9 mm-40 -63.99 -67.08 0.46 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.288 -0.882 . . . . 0.0 109.26 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.529 ' O ' HG12 ' A' ' 8' ' ' VAL . 10.1 mmtt -59.53 -44.89 93.07 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.212 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.656 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -62.86 -20.94 65.6 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.31 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.476 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 59.5 ttp -72.9 -53.03 12.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.314 -0.866 . . . . 0.0 109.334 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.529 HG12 ' O ' ' A' ' 5' ' ' LYS . 9.8 p -64.15 -20.86 27.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.202 -0.937 . . . . 0.0 109.41 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.696 ' HB1' ' HB3' ' B' ' 2' ' ' GLU . . . -80.84 -69.99 0.56 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 109.748 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.515 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.3 OUTLIER -50.64 -48.54 58.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.65 -179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 1.2 mp -58.58 -50.23 79.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.158 -0.964 . . . . 0.0 109.101 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 45.0 t0 -60.53 -19.15 56.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.108 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.923 HG11 HD11 ' B' ' 3' ' ' LEU . 2.2 t -86.98 -26.17 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.376 -0.827 . . . . 0.0 109.078 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -70.45 -46.15 64.4 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.025 -1.047 . . . . 0.0 109.109 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -77.68 -34.22 53.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.393 -0.817 . . . . 0.0 109.625 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -69.22 -64.48 0.86 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.129 -0.982 . . . . 0.0 109.383 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.785 ' CG ' HD21 ' A' ' 35' ' ' LEU . 12.0 m-85 -51.25 -53.0 39.57 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 23' ' ' ASP . 1.4 t -63.7 -25.12 68.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.275 -0.891 . . . . 0.0 109.525 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -54.92 -20.26 18.62 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -90.13 -29.44 18.3 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.256 -1.143 . . . . 0.0 109.658 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -83.35 69.94 10.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -0.931 . . . . 0.0 109.654 -179.838 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 47.02 96.7 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.4 OUTLIER 73.14 -149.59 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -1.177 . . . . 0.0 109.395 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.22 96.83 2.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.253 -0.905 . . . . 0.0 109.515 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.496 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 34.3 m-70 -145.63 -46.79 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.205 -0.935 . . . . 0.0 109.642 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 mttt -137.03 170.21 16.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.246 -0.909 . . . . 0.0 109.621 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 1.059 HD13 HD11 ' A' ' 35' ' ' LEU . 85.1 mt -115.5 131.33 56.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.191 -0.943 . . . . 0.0 109.558 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.813 ' O ' HD12 ' A' ' 32' ' ' LEU . 2.8 ptmt -76.78 164.03 26.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.206 -0.934 . . . . 0.0 108.768 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -42.5 -27.18 0.14 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.92 . . . . 0.0 109.828 -179.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.464 ' O ' ' OE1' ' A' ' 34' ' ' GLU . 3.5 m -77.45 -52.58 8.86 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.226 -0.921 . . . . 0.0 110.216 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.82 ' HB3' HD22 ' A' ' 27' ' ' LEU . 19.1 mm-40 -55.03 -39.1 68.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.307 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.061 HD13 ' CE ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -62.56 -70.17 0.22 Allowed 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.544 -0.723 . . . . 0.0 109.431 179.794 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.809 ' HD3' HG11 ' A' ' 53' ' ' VAL . 0.2 OUTLIER -43.03 -26.61 0.15 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.165 -0.96 . . . . 0.0 109.586 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.492 ' O ' ' ND2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -71.4 -51.58 23.25 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.116 -0.99 . . . . 0.0 109.455 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.059 HD11 HD13 ' A' ' 27' ' ' LEU . 2.3 mt -60.15 -51.19 70.64 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.311 -0.868 . . . . 0.0 109.856 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.988 ' CD1' HG21 ' A' ' 80' ' ' VAL . 89.8 mt -62.08 -34.29 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 109.588 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.594 ' ND2' HD11 ' A' ' 47' ' ' ILE . 2.1 m-80 -92.46 -0.95 57.3 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.679 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 34' ' ' GLU . 0.8 OUTLIER -93.83 -43.44 8.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.54 ' CG ' ' HB2' ' B' ' 3' ' ' LEU . 54.5 mp0 -122.7 -10.06 8.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.31 -0.869 . . . . 0.0 109.4 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' CB ' HD13 ' A' ' 44' ' ' LEU . 2.0 mp -108.6 -6.82 15.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.466 ' HB3' ' HA ' ' A' ' 37' ' ' ASN . 1.9 p -64.55 -10.73 27.99 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.199 -0.938 . . . . 0.0 109.478 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -98.1 -65.0 0.99 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.402 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.15 -47.26 68.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.252 -0.905 . . . . 0.0 109.314 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.063 ' CD2' HG12 ' A' ' 80' ' ' VAL . 7.7 mp -72.63 -91.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.295 -0.878 . . . . 0.0 109.345 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 1.4 mt-10 162.92 50.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.863 . . . . 0.0 109.378 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER 46.11 42.7 10.09 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.202 -0.937 . . . . 0.0 109.322 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.685 ' N ' HD13 ' A' ' 47' ' ' ILE . 0.6 OUTLIER 47.3 93.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.261 -0.9 . . . . 0.0 109.195 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.484 ' HE2' ' HB2' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -43.51 -26.88 0.24 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 109.534 -179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 47' ' ' ILE . 1.3 tp10 176.79 55.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.535 ' HA ' HG21 ' A' ' 47' ' ' ILE . 13.1 mt-30 57.96 35.46 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.274 -0.891 . . . . 0.0 109.295 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.524 ' O ' ' CG ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -71.65 -70.15 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.239 -0.913 . . . . 0.0 109.756 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 1.012 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.3 t -83.42 -11.06 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.067 -1.02 . . . . 0.0 109.68 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.809 HG11 ' HD3' ' A' ' 33' ' ' LYS . 43.0 t -84.23 -37.43 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 120.828 -1.17 . . . . 0.0 108.32 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 2.2 t0 -90.2 -22.1 21.84 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 51' ' ' GLU . 5.0 mttm -87.49 -48.42 7.96 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.488 -0.757 . . . . 0.0 109.207 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.869 HG22 HD21 ' A' ' 60' ' ' LEU . 1.2 p -64.19 -42.63 96.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 O-C-N 121.179 -0.951 . . . . 0.0 109.094 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 1.061 ' CE ' HD13 ' A' ' 32' ' ' LEU . 10.7 tpp -43.48 -45.49 6.45 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 61' ' ' ASP . 5.4 tt0 -61.22 -44.17 97.7 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.236 -0.915 . . . . 0.0 108.827 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.0 m -62.55 -18.92 63.05 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.372 -0.83 . . . . 0.0 109.411 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.869 HD21 HG22 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -91.5 28.82 1.61 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.196 -0.94 . . . . 0.0 108.898 179.571 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 6.6 t0 -85.99 98.48 10.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.298 -0.876 . . . . 0.0 109.489 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.9 -23.33 14.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -140.22 9.71 2.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.261 -0.899 . . . . 0.0 109.47 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.425 ' HA2' ' OD1' ' A' ' 61' ' ' ASP . . . 69.03 83.62 0.16 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 178.8 -33.55 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.22 -1.164 . . . . 0.0 108.576 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 14.52 13.32 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB2' ' CB ' ' A' ' 26' ' ' LYS . 3.3 pt-20 -87.28 114.93 24.33 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.3 -1.118 . . . . 0.0 109.469 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.599 ' HB2' HD21 ' A' ' 32' ' ' LEU . 18.8 t -69.74 157.79 36.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -120.69 172.15 8.08 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.526 ' CZ ' HG13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -64.73 -55.96 16.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.085 -1.009 . . . . 0.0 110.129 -179.81 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.497 ' HG3' ' N ' ' A' ' 72' ' ' GLU . 8.4 pt20 -62.14 -39.4 92.46 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' CB ' ' A' ' 76' ' ' PHE . 1.5 tt0 -78.68 -10.43 59.75 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.574 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 34.2 t80 -73.73 -51.44 16.52 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.562 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -64.69 -46.99 80.02 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.03 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -68.32 -20.75 64.77 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.319 -0.863 . . . . 0.0 109.012 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.705 ' CE1' HD11 ' A' ' 36' ' ' ILE . 4.6 t80 -66.68 -70.39 0.25 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.192 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.526 HG21 ' CD2' ' B' ' 3' ' ' LEU . 81.5 t -60.18 -30.38 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.236 -0.915 . . . . 0.0 108.934 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.651 ' HB2' ' CG ' ' B' ' 74' ' ' MET . . . -60.29 -41.99 94.53 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.415 -0.803 . . . . 0.0 109.196 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.657 ' HE2' HG23 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -63.33 -50.74 68.81 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.163 -0.961 . . . . 0.0 108.701 179.503 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 1.063 HG12 ' CD2' ' A' ' 44' ' ' LEU . 1.5 t -65.33 -9.53 7.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.696 0 O-C-N 121.085 -1.009 . . . . 0.0 109.583 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.939 HG21 ' SD ' ' B' ' 7' ' ' MET . 52.7 m -86.85 -57.76 2.85 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.223 -0.923 . . . . 0.0 109.382 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.8 t -81.91 -48.81 11.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.162 -0.961 . . . . 0.0 109.138 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.584 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -39.42 -42.65 1.12 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.704 -0.622 . . . . 0.0 109.871 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 15.7 t -56.16 -51.3 68.5 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.903 . . . . 0.0 109.519 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 29.8 m-70 -74.2 -9.98 59.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 109.497 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.515 ' O ' ' CG ' ' A' ' 89' ' ' GLU . 3.2 mt-10 -75.07 -34.86 61.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.262 -0.899 . . . . 0.0 109.6 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' A' ' 86' ' ' GLU . 4.3 t80 -43.8 -29.02 0.48 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 109.593 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.421 ' O ' ' C ' ' A' ' 89' ' ' GLU . 82.4 t80 -90.11 -35.38 15.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.246 -0.909 . . . . 0.0 109.577 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.515 ' CG ' ' O ' ' A' ' 86' ' ' GLU . 0.7 OUTLIER -43.9 155.83 0.07 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.248 -0.908 . . . . 0.0 109.548 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -142.92 -161.69 1.3 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.217 -0.927 . . . . 0.0 109.492 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.504 179.945 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.534 ' HB2' ' CB ' ' B' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.696 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 3.6 mm-40 -76.13 -35.85 59.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 109.3 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.923 HD11 HG11 ' A' ' 13' ' ' VAL . 7.5 mp -78.99 -28.1 43.44 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.285 -0.885 . . . . 0.0 109.442 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.534 ' CB ' ' HB2' ' B' ' 1' ' ' SER . 4.9 tm-20 -68.84 -58.84 3.6 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.899 . . . . 0.0 109.192 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.595 ' O ' HG12 ' B' ' 8' ' ' VAL . 19.4 mttt -62.61 -37.2 85.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.223 -0.923 . . . . 0.0 109.161 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.602 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -66.9 -19.52 65.74 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.38 -0.825 . . . . 0.0 109.308 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.939 ' SD ' HG21 ' A' ' 81' ' ' THR . 10.4 tpt -81.84 -38.47 25.42 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.342 -0.849 . . . . 0.0 109.368 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.595 HG12 ' O ' ' B' ' 5' ' ' LYS . 2.6 p -68.27 -30.89 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.286 -0.884 . . . . 0.0 109.413 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.773 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -82.47 -52.46 6.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 109.395 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.661 HD12 ' CE2' ' B' ' 73' ' ' PHE . 3.4 mm? -53.29 -40.87 65.07 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.813 HD13 ' O ' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -68.86 -46.37 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.376 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.58 ' N ' HG23 ' B' ' 11' ' ' ILE . 0.3 OUTLIER -51.89 -26.83 11.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 109.239 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 1.014 HG13 ' CD1' ' B' ' 17' ' ' TYR . 18.9 t -86.81 -30.87 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.26 -0.9 . . . . 0.0 109.366 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 2.7 t80 -59.48 -56.92 15.92 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.834 -1.166 . . . . 0.0 109.027 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.561 ' CE1' ' HB2' ' B' ' 24' ' ' LYS . 3.4 t60 -72.79 -48.41 38.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 109.636 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 44.9 tt0 -50.5 -68.39 0.18 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.841 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 1.014 ' CD1' HG13 ' B' ' 13' ' ' VAL . 25.4 m-85 -52.97 -32.77 47.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 110.072 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 86.3 p -87.36 31.57 0.73 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.044 -1.035 . . . . 0.0 109.942 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.02 -0.34 48.21 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.87 -58.27 2.63 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -1.17 . . . . 0.0 109.49 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.49 168.58 18.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.229 -0.92 . . . . 0.0 109.477 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.17 -105.88 3.17 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' B' ' 24' ' ' LYS . 0.2 OUTLIER -148.97 -68.67 0.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -1.143 . . . . 0.0 109.476 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.561 ' HB2' ' CE1' ' B' ' 15' ' ' HIS . 2.8 pttt 168.8 39.32 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.91 . . . . 0.0 109.503 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.574 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 3.9 p80 -169.74 27.53 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.164 -0.96 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.713 ' O ' HD23 ' B' ' 27' ' ' LEU . 4.5 ptpt -153.97 167.66 29.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.799 HD22 ' HB3' ' B' ' 31' ' ' GLU . 78.9 mt -138.34 119.2 14.22 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.226 -0.921 . . . . 0.0 109.874 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.0 OUTLIER -85.77 118.86 25.53 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.279 -0.888 . . . . 0.0 108.666 179.114 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.535 ' N ' ' CE ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER 20.1 -78.76 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.598 ' N ' ' O ' ' B' ' 28' ' ' LYS . 69.3 p -40.73 -58.42 1.65 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.979 -1.075 . . . . 0.0 110.794 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.799 ' HB3' HD22 ' B' ' 27' ' ' LEU . 31.1 mm-40 -45.93 -43.84 14.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.903 -1.123 . . . . 0.0 109.166 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' B' ' 27' ' ' LEU . 20.2 mt -53.26 -66.07 0.45 Allowed 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.56 -0.713 . . . . 0.0 109.12 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.619 ' HG3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -43.62 -36.27 2.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 109.646 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -54.97 -63.08 1.27 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 109.416 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.733 HD11 ' CG1' ' B' ' 13' ' ' VAL . 1.1 mp -50.71 -36.66 37.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.58 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.962 HD13 HG22 ' B' ' 53' ' ' VAL . 4.1 mt -61.43 -39.27 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.706 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.765 HD21 HD11 ' B' ' 47' ' ' ILE . 0.7 OUTLIER -96.38 -70.08 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.1 -1.0 . . . . 0.0 109.679 -179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -45.72 -24.34 0.35 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.289 -0.882 . . . . 0.0 109.963 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.883 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -113.91 -40.8 3.67 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.077 -1.015 . . . . 0.0 109.941 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.988 HD23 ' CD1' ' B' ' 44' ' ' LEU . 0.1 OUTLIER -109.52 67.98 0.66 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.132 -0.98 . . . . 0.0 109.601 -179.821 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 58.5 p -120.65 43.71 2.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.455 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.515 ' CE1' ' HB2' ' B' ' 43' ' ' PHE . 9.5 p80 -129.65 -47.12 1.16 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.512 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.515 ' HB2' ' CE1' ' B' ' 42' ' ' HIS . 0.2 OUTLIER -110.67 9.18 22.88 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.988 ' CD1' HD23 ' B' ' 40' ' ' LEU . 6.5 mp -106.51 -21.62 13.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.256 -0.902 . . . . 0.0 109.489 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.426 ' C ' ' O ' ' B' ' 44' ' ' LEU . 12.9 mt-10 43.8 68.6 0.5 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 63.89 155.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.895 . . . . 0.0 109.465 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.765 HD11 HD21 ' B' ' 37' ' ' ASN . 31.1 mm -64.96 -24.4 35.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.456 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.2 OUTLIER 84.4 -52.15 0.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.712 -0.618 . . . . 0.0 109.592 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.522 ' N ' ' CG ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER -174.21 34.96 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.5 ' HA ' HG21 ' B' ' 47' ' ' ILE . 5.8 mt-30 73.73 38.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -65.47 -70.26 0.25 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.178 -0.951 . . . . 0.0 109.394 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.879 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.4 t -87.56 -15.41 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.142 -0.974 . . . . 0.0 109.152 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.962 HG22 HD13 ' B' ' 36' ' ' ILE . 39.5 t -75.17 -29.83 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.204 -0.935 . . . . 0.0 108.746 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 6.1 t0 -90.13 -36.92 14.56 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.425 -0.797 . . . . 0.0 109.314 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.471 ' HA ' ' OE2' ' B' ' 58' ' ' GLU . 23.7 mtpp -70.63 -36.17 73.32 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.316 -0.865 . . . . 0.0 109.534 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.964 ' HB ' HD13 ' B' ' 60' ' ' LEU . 5.3 m -55.44 -56.13 13.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.642 ' H ' HG23 ' B' ' 56' ' ' VAL . 0.2 OUTLIER -41.11 -28.32 0.09 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.93 -1.106 . . . . 0.0 109.625 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.471 ' OE2' ' HA ' ' B' ' 55' ' ' LYS . 45.0 mt-10 -70.06 -55.6 9.09 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.467 ' O ' ' C ' ' B' ' 60' ' ' LEU . 2.8 m -82.81 -63.06 1.44 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 1.053 HD21 ' CG ' ' B' ' 76' ' ' PHE . 1.7 mp -37.2 -36.5 0.14 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.761 -0.587 . . . . 0.0 109.898 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.524 ' CB ' ' O ' ' B' ' 57' ' ' MET . 11.1 t0 -90.11 70.03 7.29 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.398 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -100.09 8.88 43.61 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.9 -10.74 17.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.468 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 63.85 78.39 0.19 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 58.8 t0 178.99 -33.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.25 -1.147 . . . . 0.0 108.602 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.06 -9.37 31.52 Favored Glycine 0 N--CA 1.486 1.973 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.432 ' HB2' ' HD3' ' B' ' 26' ' ' LYS . 12.2 pt-20 -95.56 123.74 39.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -1.148 . . . . 0.0 109.474 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -69.63 133.42 47.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.273 -0.892 . . . . 0.0 109.338 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 23.0 t70 -98.05 170.76 8.7 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.672 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -55.74 -47.7 76.49 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.042 . . . . 0.0 110.061 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.444 ' HG2' ' SD ' ' A' ' 79' ' ' MET . 65.6 mt-30 -50.56 -49.31 56.41 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 121.546 -0.721 . . . . 0.0 109.319 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.546 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -72.17 -20.83 61.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.541 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.661 ' CE2' HD12 ' B' ' 10' ' ' LEU . 71.8 t80 -59.86 -57.78 11.42 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.651 ' CG ' ' HB2' ' A' ' 78' ' ' ALA . 3.4 mtt -66.61 -44.14 82.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.332 -0.855 . . . . 0.0 109.605 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.928 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -68.61 -12.21 61.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.081 -1.012 . . . . 0.0 109.21 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 1.053 ' CG ' HD21 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -81.52 -70.52 0.53 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.337 -0.852 . . . . 0.0 109.282 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.989 HG21 HD23 ' A' ' 3' ' ' LEU . 98.5 t -60.59 -30.25 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.88 . . . . 0.0 108.858 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.562 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -66.16 -45.57 80.49 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.459 -0.776 . . . . 0.0 109.378 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.643 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 4.3 mmm -63.17 -70.34 0.22 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.059 -1.026 . . . . 0.0 108.914 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.879 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -41.81 -26.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 120.891 -1.131 . . . . 0.0 109.553 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.535 ' HA ' HD21 ' B' ' 40' ' ' LEU . 15.2 m -71.05 -70.23 0.32 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.053 -1.03 . . . . 0.0 108.885 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.0 OUTLIER -79.23 -50.77 10.41 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.113 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.4 -37.93 0.14 Allowed 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.262 0.553 . . . . 0.0 109.848 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 8.6 t -84.88 -39.53 18.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 109.557 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.486 ' NE2' ' CE2' ' B' ' 43' ' ' PHE . 0.8 OUTLIER -65.38 -9.98 29.49 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.605 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.492 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 0.5 OUTLIER -87.78 -21.55 25.06 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.241 -0.912 . . . . 0.0 109.525 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.464 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.9 t80 -43.69 -32.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.286 -0.884 . . . . 0.0 109.519 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.08 -43.48 24.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 109.454 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' B' ' 89' ' ' GLU . 4.0 pm0 -95.06 117.91 30.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.944 . . . . 0.0 109.435 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.45 53.81 0.76 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.259 -0.901 . . . . 0.0 109.469 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.449 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.475 ' N ' ' HB2' ' A' ' 4' ' ' GLU . 1.1 t . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.753 ' HB2' ' HB1' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -47.65 -49.2 28.03 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.308 -0.87 . . . . 0.0 109.534 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.867 HD11 HG21 ' B' ' 13' ' ' VAL . 2.3 mp -76.49 -23.38 53.78 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.475 ' HB2' ' N ' ' A' ' 1' ' ' SER . 2.0 mt-10 -62.42 -63.91 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.346 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.36 -38.59 90.13 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.311 -0.868 . . . . 0.0 109.297 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -70.63 -15.55 62.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.298 -0.876 . . . . 0.0 109.428 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.06 -46.49 16.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.316 -0.865 . . . . 0.0 109.385 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.11 -41.93 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.457 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HB1' ' OE1' ' B' ' 2' ' ' GLU . . . -67.7 -54.18 21.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.922 . . . . 0.0 109.42 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.532 ' HG ' ' CD1' ' B' ' 3' ' ' LEU . 0.2 OUTLIER -47.68 -46.37 29.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.2 -0.937 . . . . 0.0 109.397 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 45.5 mt -59.3 -38.95 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.286 -0.884 . . . . 0.0 109.396 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 91.3 m-20 -64.63 -24.46 67.59 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.262 -0.899 . . . . 0.0 109.532 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.918 HG21 HD21 ' B' ' 3' ' ' LEU . 2.7 t -81.01 -29.87 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.463 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 10.9 t80 -69.63 -47.77 62.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.941 -1.099 . . . . 0.0 109.507 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -78.99 -33.43 45.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.558 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.527 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 39.1 tt0 -68.82 -64.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.907 . . . . 0.0 109.468 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.69 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 26.0 m-85 -55.4 -48.23 74.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.5 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 33.7 t -69.64 -19.03 63.62 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.289 -0.882 . . . . 0.0 109.47 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.38 16.09 59.77 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 22.4 mmm180 -81.46 -46.65 14.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.492 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 28' ' ' LYS . 1.0 OUTLIER -74.2 169.72 17.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.277 -0.889 . . . . 0.0 109.498 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -44.54 -52.87 7.28 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -68.0 -162.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -1.169 . . . . 0.0 109.421 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 179.5 80.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.297 -0.877 . . . . 0.0 109.449 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -152.82 -39.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.282 -0.886 . . . . 0.0 109.527 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -144.13 168.11 20.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.587 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.899 HD22 ' HB3' ' A' ' 31' ' ' GLU . 56.6 mt -86.17 152.08 23.12 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.261 -0.899 . . . . 0.0 109.339 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -119.16 69.45 0.82 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.777 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HD3' ' N ' ' A' ' 30' ' ' SER . 1.6 tmtt? 64.48 -81.6 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.518 -0.739 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.53 ' N ' ' HD3' ' A' ' 29' ' ' LYS . 4.3 m -48.28 -32.4 7.25 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.87 -1.144 . . . . 0.0 110.187 -179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.899 ' HB3' HD22 ' A' ' 27' ' ' LEU . 7.4 mm-40 -64.5 -43.01 95.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.962 -1.086 . . . . 0.0 108.568 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.651 HD22 HD13 ' A' ' 27' ' ' LEU . 3.2 mm? -55.93 -61.45 2.37 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.977 ' HG3' HG11 ' A' ' 53' ' ' VAL . 2.3 ttmt -52.15 -36.58 51.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.44 -0.788 . . . . 0.0 109.829 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -38.44 79.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.196 -0.94 . . . . 0.0 109.534 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.758 HD23 ' CE2' ' A' ' 76' ' ' PHE . 13.3 tp -75.14 -38.68 60.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.338 -0.851 . . . . 0.0 109.995 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.911 HG23 HD22 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -75.75 -14.16 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 109.744 -179.513 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.474 ' HA ' ' OG ' ' A' ' 41' ' ' SER . 1.8 m-80 -93.82 -57.02 2.68 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.973 -1.08 . . . . 0.0 109.756 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -73.92 -10.94 60.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.236 -0.915 . . . . 0.0 109.723 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.802 ' C ' HD12 ' A' ' 40' ' ' LEU . 2.5 mm-40 -121.01 -33.31 3.76 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.065 -1.022 . . . . 0.0 109.968 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.028 ' HB3' HD21 ' A' ' 44' ' ' LEU . 7.4 mp -117.9 66.0 0.75 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.047 -1.033 . . . . 0.0 109.606 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.479 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 7.7 m -138.99 26.88 2.42 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -0.878 . . . . 0.0 109.374 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -164.68 -47.57 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.214 -0.929 . . . . 0.0 109.488 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.477 ' HD2' ' HE3' ' B' ' 7' ' ' MET . 3.8 t80 -65.63 -71.89 0.17 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.028 HD21 ' HB3' ' A' ' 40' ' ' LEU . 0.6 OUTLIER -78.65 -148.47 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.225 -0.922 . . . . 0.0 109.27 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.645 ' H ' HD12 ' A' ' 44' ' ' LEU . 2.1 mm-40 -90.05 107.92 19.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.156 -0.965 . . . . 0.0 109.382 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 41' ' ' SER . 2.0 mt-10 -43.73 158.16 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.31 -0.869 . . . . 0.0 109.244 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 1.053 HD12 HG23 ' A' ' 53' ' ' VAL . 24.3 mm -69.24 -53.7 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.206 -0.934 . . . . 0.0 109.434 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 49' ' ' GLU . 4.7 pttt 39.7 25.22 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.666 -0.646 . . . . 0.0 111.185 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 4.4 mt-10 161.13 34.07 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.998 -1.063 . . . . 0.0 110.244 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.747 ' N ' HG22 ' A' ' 47' ' ' ILE . 32.0 mt-30 40.33 37.11 0.39 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.278 -0.889 . . . . 0.0 109.748 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -68.45 -70.51 0.26 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.157 -0.964 . . . . 0.0 109.627 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.946 HG11 ' HA ' ' A' ' 80' ' ' VAL . 1.3 t -80.86 -9.78 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.058 -1.026 . . . . 0.0 109.158 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.053 HG23 HD12 ' A' ' 47' ' ' ILE . 55.9 t -80.83 -45.91 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.19 -0.944 . . . . 0.0 108.939 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -75.14 -28.3 60.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.457 -0.777 . . . . 0.0 108.959 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -56.33 4.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.39 -0.819 . . . . 0.0 109.257 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 1.1 HG11 HG22 ' A' ' 80' ' ' VAL . 17.1 m -57.08 -48.15 82.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.054 -1.029 . . . . 0.0 109.542 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.608 ' N ' HG23 ' A' ' 56' ' ' VAL . 19.1 tpp -42.89 -45.14 4.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.205 -0.934 . . . . 0.0 109.68 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.77 -49.25 73.64 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.18 -0.95 . . . . 0.0 109.489 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.583 HG21 ' SD ' ' A' ' 79' ' ' MET . 4.5 t -77.53 -8.97 58.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.288 -0.883 . . . . 0.0 109.913 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.651 HD13 HD12 ' A' ' 32' ' ' LEU . 13.2 mt -97.27 11.58 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 109.397 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -77.97 113.88 16.3 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.245 -0.909 . . . . 0.0 109.511 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.524 ' ND2' ' HB2' ' A' ' 69' ' ' ASP . 13.6 t-20 -60.28 -50.37 73.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 109.477 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -150.35 16.5 0.82 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.176 -0.953 . . . . 0.0 109.589 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.08 75.18 1.29 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -176.98 30.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -1.163 . . . . 0.0 108.406 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 49.31 22.43 3.52 Favored Glycine 0 N--CA 1.482 1.758 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 1.3 mt-10 -106.76 96.57 6.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -1.141 . . . . 0.0 109.436 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.516 ' SG ' HD21 ' A' ' 32' ' ' LEU . 56.3 m -69.97 162.25 28.46 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.218 -0.926 . . . . 0.0 109.835 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.524 ' HB2' ' ND2' ' A' ' 62' ' ' ASN . 20.9 t70 -128.18 170.95 12.4 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.687 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -52.55 -51.22 60.74 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.093 -1.004 . . . . 0.0 110.203 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.47 ' HB3' ' SD ' ' B' ' 79' ' ' MET . 0.5 OUTLIER -54.82 -30.6 57.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.28 -0.887 . . . . 0.0 109.103 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' CD2' ' A' ' 60' ' ' LEU . 3.8 mt-10 -82.52 -24.87 33.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' B' ' 3' ' ' LEU . 1.2 t80 -63.93 -57.55 9.44 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.121 -0.987 . . . . 0.0 108.642 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.909 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.1 OUTLIER -64.15 -48.88 74.33 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.343 -0.848 . . . . 0.0 108.763 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -55.52 -25.16 35.92 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.878 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -67.29 -69.41 0.31 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.438 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.878 HG23 ' CE2' ' A' ' 76' ' ' PHE . 40.0 t -53.45 -21.11 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.408 -0.807 . . . . 0.0 109.057 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.866 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.05 -50.29 64.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.332 -0.855 . . . . 0.0 109.484 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.657 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 44.8 mtp -73.6 -63.56 1.18 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.62 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 1.1 HG22 HG11 ' A' ' 56' ' ' VAL . 0.1 OUTLIER -47.32 -22.83 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.842 0 O-C-N 120.565 -1.335 . . . . 0.0 109.41 -179.059 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.517 HG23 HD11 ' B' ' 11' ' ' ILE . 3.3 m -80.32 -68.83 0.64 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.03 -1.044 . . . . 0.0 109.123 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.554 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.8 t -74.32 -49.46 22.87 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.98 -1.075 . . . . 0.0 109.088 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.19 -31.08 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.421 0.629 . . . . 0.0 109.607 179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' SG ' ' CG ' ' A' ' 45' ' ' GLU . 10.9 t -81.03 -58.36 3.11 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.353 -0.842 . . . . 0.0 109.288 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -45.05 -60.99 1.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.279 -0.888 . . . . 0.0 109.482 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -53.42 -47.53 69.53 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.39 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 58.8 t80 -46.67 -39.02 10.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.232 -0.917 . . . . 0.0 109.516 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -62.68 -53.66 51.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.231 -0.918 . . . . 0.0 109.442 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' A' ' 90' ' ' HIS . 5.0 mt-10 -63.17 169.9 3.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 109.408 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.46 ' O ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER 61.45 135.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.217 -0.927 . . . . 0.0 109.46 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.509 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.661 ' HG3' HG23 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -70.96 -70.08 0.33 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.92 . . . . 0.0 109.485 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.918 HD21 HG21 ' A' ' 13' ' ' VAL . 3.3 mm? -75.12 -17.59 60.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.26 -0.9 . . . . 0.0 109.393 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' B' ' 7' ' ' MET . 22.5 tt0 -73.36 -61.72 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.418 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.612 ' O ' HG12 ' B' ' 8' ' ' VAL . 7.4 ttmt -61.0 -51.19 70.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.057 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -58.86 -15.76 14.09 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.311 -0.868 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.505 ' SD ' ' CD1' ' B' ' 11' ' ' ILE . 0.0 OUTLIER -82.29 -53.86 5.7 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.612 HG12 ' O ' ' B' ' 5' ' ' LYS . 9.4 p -55.7 -28.55 23.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.241 -0.912 . . . . 0.0 109.545 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.753 ' HB1' ' HB2' ' A' ' 2' ' ' GLU . . . -78.47 -62.91 1.53 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.207 -0.933 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.607 ' O ' HG12 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -50.71 -21.71 1.74 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.21 -0.931 . . . . 0.0 109.557 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 81' ' ' THR . 73.8 mt -77.02 -62.43 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -48.17 -23.39 0.84 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.231 -0.918 . . . . 0.0 109.535 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.867 HG21 HD11 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -81.61 -40.38 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.513 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.561 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 28.1 t80 -57.05 -50.5 72.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.12 -0.987 . . . . 0.0 109.254 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.475 ' HA ' ' HB2' ' B' ' 18' ' ' SER . 14.7 m170 -67.85 -35.92 79.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.412 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -51.56 -57.45 9.06 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.484 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.935 ' CD2' HD21 ' B' ' 35' ' ' LEU . 78.8 m-85 -64.82 -28.05 69.3 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.225 -0.922 . . . . 0.0 109.482 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' B' ' 24' ' ' LYS . 0.6 OUTLIER -65.72 -20.94 66.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.925 . . . . 0.0 109.521 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.51 16.99 59.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 29.5 mmt180 -90.08 -57.48 2.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.256 -1.143 . . . . 0.0 109.432 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 165.73 23.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.297 -0.877 . . . . 0.0 109.409 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.11 -122.59 5.86 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' HB2' ' HE2' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -94.03 -156.59 0.5 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.292 -1.122 . . . . 0.0 109.517 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.523 ' O ' ' CG ' ' B' ' 25' ' ' HIS . 13.0 mtmm -132.46 28.09 4.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 24' ' ' LYS . 16.0 m170 -162.46 26.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.268 -0.895 . . . . 0.0 109.47 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.06 143.59 2.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.283 -0.885 . . . . 0.0 109.445 -179.959 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.708 HD12 ' CB ' ' B' ' 31' ' ' GLU . 0.9 OUTLIER -93.24 167.27 11.86 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.957 . . . . 0.0 109.555 179.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.1 OUTLIER -135.7 80.58 1.84 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.388 -0.82 . . . . 0.0 109.369 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 64.0 -84.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.74 . . . . 0.0 110.32 179.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.416 ' C ' ' O ' ' B' ' 29' ' ' LYS . 2.5 m -41.71 -57.51 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.136 -0.978 . . . . 0.0 110.482 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.708 ' CB ' HD12 ' B' ' 27' ' ' LEU . 64.7 mm-40 -61.15 -33.07 72.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.897 -1.127 . . . . 0.0 109.597 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.655 ' CD1' ' HE2' ' B' ' 57' ' ' MET . 52.4 mt -56.0 -68.87 0.17 Allowed 'General case' 0 C--N 1.298 -1.658 0 O-C-N 121.386 -0.821 . . . . 0.0 108.847 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.559 ' CD ' HG11 ' B' ' 53' ' ' VAL . 2.8 mttt -44.15 -33.88 1.66 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.32 -0.863 . . . . 0.0 109.073 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.0 OUTLIER -58.73 -66.57 0.48 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.297 -0.877 . . . . 0.0 109.478 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.935 HD21 ' CD2' ' B' ' 17' ' ' TYR . 4.2 mm? -42.7 -40.65 2.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.88 . . . . 0.0 109.737 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.827 HD11 ' CZ ' ' B' ' 76' ' ' PHE . 2.8 mm -59.92 -50.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.227 -0.92 . . . . 0.0 109.687 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.462 ' OD1' ' O ' ' B' ' 44' ' ' LEU . 1.2 m-20 -81.14 6.29 14.25 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.235 -0.915 . . . . 0.0 109.612 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -127.44 7.03 6.35 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.184 -0.947 . . . . 0.0 109.714 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.869 ' CD ' HG22 ' B' ' 77' ' ' VAL . 5.8 pt-20 -142.87 -33.74 0.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.177 -0.952 . . . . 0.0 110.155 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 1.018 ' CD1' HD13 ' B' ' 44' ' ' LEU . 3.8 mm? -52.55 -69.07 0.12 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.016 -1.052 . . . . 0.0 109.403 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 2.9 p 162.24 -54.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.397 -0.815 . . . . 0.0 109.389 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.494 ' CD2' ' HB2' ' B' ' 41' ' ' SER . 4.9 p80 178.73 -36.97 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 109.363 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.4 ' CD2' ' CE1' ' B' ' 42' ' ' HIS . 5.5 m-85 -60.75 -26.56 67.31 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.246 -0.909 . . . . 0.0 109.419 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 1.018 HD13 ' CD1' ' B' ' 40' ' ' LEU . 1.0 OUTLIER -100.88 31.14 3.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.285 -0.884 . . . . 0.0 109.427 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' B' ' 37' ' ' ASN . 88.0 tt0 -47.1 -46.79 23.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.446 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.531 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 1.2 pm0 -129.95 16.69 5.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.282 -0.886 . . . . 0.0 109.418 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.727 HG21 ' HA ' ' B' ' 50' ' ' GLN . 14.5 mm 82.7 -19.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.678 -0.639 . . . . 0.0 110.247 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 84.58 -36.28 0.06 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.392 -0.818 . . . . 0.0 109.82 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.539 ' N ' ' HG2' ' B' ' 48' ' ' LYS . 5.0 tt0 178.46 33.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.076 -1.015 . . . . 0.0 109.48 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.727 ' HA ' HG21 ' B' ' 47' ' ' ILE . 0.9 OUTLIER 50.14 51.32 16.92 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.13 -57.28 2.91 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.201 -0.937 . . . . 0.0 109.635 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.838 HG11 ' HA ' ' B' ' 80' ' ' VAL . 40.1 t -86.97 -13.58 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.655 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.679 HG21 HG13 ' B' ' 47' ' ' ILE . 37.7 t -77.47 -15.62 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 120.902 -1.124 . . . . 0.0 109.339 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -48.84 6.94 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.225 -0.922 . . . . 0.0 109.327 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -72.31 -42.04 65.89 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.302 -0.874 . . . . 0.0 109.383 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.978 HG21 ' CE1' ' B' ' 76' ' ' PHE . 5.4 p -56.4 -46.48 81.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.203 -0.936 . . . . 0.0 109.386 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.655 ' HE2' ' CD1' ' B' ' 32' ' ' LEU . 8.1 tpp -42.79 -47.1 5.43 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.416 -0.802 . . . . 0.0 109.169 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.447 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.9 OUTLIER -57.14 -45.11 83.81 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.296 -0.877 . . . . 0.0 109.749 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.712 HG22 ' O ' ' B' ' 56' ' ' VAL . 3.9 t -75.14 -12.24 60.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.165 -0.96 . . . . 0.0 110.077 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.605 HD21 ' CG ' ' B' ' 76' ' ' PHE . 34.1 mt -91.12 -9.03 47.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.34 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 17.1 p-10 -62.6 113.39 2.96 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.276 -0.89 . . . . 0.0 109.576 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.516 ' CA ' ' OE2' ' B' ' 72' ' ' GLU . 9.1 p-10 -81.17 -45.89 15.69 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.266 -0.896 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.43 ' N ' ' CG ' ' B' ' 62' ' ' ASN . 0.6 OUTLIER -131.77 1.0 3.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 75.51 1.2 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -175.3 29.83 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -1.156 . . . . 0.0 108.385 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.3 26.26 6.6 Favored Glycine 0 N--CA 1.483 1.782 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.454 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 87.0 mt-10 -105.76 111.95 24.83 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -1.136 . . . . 0.0 109.437 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.525 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 16.2 t -69.64 159.02 34.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.493 ' N ' ' SG ' ' B' ' 68' ' ' CYS . 0.3 OUTLIER -130.03 172.54 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.424 -0.797 . . . . 0.0 109.249 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.467 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.2 OUTLIER -58.33 -53.56 56.88 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.377 -0.827 . . . . 0.0 110.466 -179.667 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.714 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.87 -40.55 89.03 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.28 -0.887 . . . . 0.0 108.611 -179.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.516 ' OE2' ' CA ' ' B' ' 62' ' ' ASN . 0.3 OUTLIER -76.48 -12.07 59.98 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.442 -0.786 . . . . 0.0 109.083 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.561 ' HB2' ' CE1' ' B' ' 14' ' ' PHE . 8.5 t80 -73.26 -57.99 3.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.866 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -59.51 -45.72 90.91 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.102 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -60.02 -33.18 71.65 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.353 -0.842 . . . . 0.0 108.784 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.978 ' CE1' HG21 ' B' ' 56' ' ' VAL . 1.0 OUTLIER -57.26 -70.03 0.14 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.014 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.869 HG22 ' CD ' ' B' ' 39' ' ' GLU . 6.7 t -50.22 -32.34 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.468 -0.77 . . . . 0.0 109.31 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.909 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -58.98 -45.55 90.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 109.867 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.695 ' HE3' HG21 ' B' ' 59' ' ' THR . 2.7 mpp? -76.46 -68.4 0.6 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.197 -0.94 . . . . 0.0 109.825 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.838 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.29 -24.0 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.452 -1.405 . . . . 0.0 109.441 -179.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.504 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 8.5 m -77.7 -68.1 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.051 -1.031 . . . . 0.0 108.916 178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -79.08 -49.65 12.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.204 -0.935 . . . . 0.0 108.798 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.69 -37.43 0.22 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.742 -0.599 . . . . 0.0 109.789 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 43.3 t -72.96 -48.31 37.79 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.3 -0.875 . . . . 0.0 109.47 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.66 -10.06 32.86 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.243 -0.911 . . . . 0.0 109.473 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -38.52 69.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.185 -0.947 . . . . 0.0 109.411 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.82 -32.55 63.76 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.305 -0.872 . . . . 0.0 109.442 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.494 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 0.3 OUTLIER -57.62 -40.46 79.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.439 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.494 ' CB ' ' O ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER 76.58 -79.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.55 -161.74 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.194 -0.941 . . . . 0.0 109.456 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.484 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 29.6 t . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.371 0.605 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.32 -70.67 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.284 -0.885 . . . . 0.0 109.913 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.92 HD22 ' OE2' ' B' ' 39' ' ' GLU . 6.0 mt -78.51 -33.13 48.3 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.118 -0.989 . . . . 0.0 110.02 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' MET . 11.5 tt0 -57.77 -59.97 4.41 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.086 -1.008 . . . . 0.0 109.246 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.17 -53.21 59.86 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.347 -0.845 . . . . 0.0 109.469 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -61.24 -12.84 14.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.295 -0.878 . . . . 0.0 109.671 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.781 ' O ' HD12 ' A' ' 11' ' ' ILE . 4.9 ttp -80.29 -60.43 2.33 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.172 -0.955 . . . . 0.0 109.435 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 8' ' ' VAL . 4.2 t -55.01 -27.89 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.237 -0.915 . . . . 0.0 109.482 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -77.82 -64.31 1.18 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.63 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.52 ' CD2' ' HG3' ' A' ' 74' ' ' MET . 0.2 OUTLIER -43.3 -53.4 5.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 0.0 109.754 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.781 HD12 ' O ' ' A' ' 7' ' ' MET . 2.1 mp -59.24 -45.88 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.275 -0.891 . . . . 0.0 109.583 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 8' ' ' VAL . 0.5 OUTLIER -55.74 -23.48 29.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.195 -0.941 . . . . 0.0 109.413 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.868 ' CG1' HD21 ' A' ' 35' ' ' LEU . 1.2 t -89.13 -27.09 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.259 -0.901 . . . . 0.0 109.231 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.583 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 10.3 t80 -64.67 -42.4 95.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.012 -1.055 . . . . 0.0 109.057 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.568 ' CE1' ' CE1' ' A' ' 25' ' ' HIS . 3.8 m-70 -82.4 -44.37 16.18 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.325 -0.859 . . . . 0.0 109.518 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -52.8 -59.44 4.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.512 ' CD1' HG13 ' A' ' 13' ' ' VAL . 34.6 m-85 -61.85 -45.76 92.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.275 -0.891 . . . . 0.0 109.616 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.758 ' OG ' HD12 ' A' ' 27' ' ' LEU . 48.2 m -72.26 -3.08 21.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.772 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 15' ' ' HIS . . . -75.1 -9.16 83.95 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HD3' ' OE2' ' A' ' 31' ' ' GLU . 16.9 mtt85 -87.93 -34.68 18.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.305 -1.115 . . . . 0.0 109.462 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HG3' ' HB3' ' A' ' 28' ' ' LYS . 8.9 tt0 -69.94 154.4 42.0 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.299 -0.876 . . . . 0.0 109.381 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 21' ' ' GLU . . . -43.49 -26.94 0.73 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' OD2' ' HD3' ' A' ' 26' ' ' LYS . 37.1 t70 -112.34 135.62 52.8 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 18' ' ' SER . 6.4 ptmt -91.99 70.91 5.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.287 -0.883 . . . . 0.0 109.571 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.576 ' O ' ' CZ ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -170.2 -34.79 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -118.75 151.05 38.74 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.975 . . . . 0.0 109.785 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.863 HD22 HD23 ' A' ' 32' ' ' LEU . 7.2 mp -89.77 165.92 13.87 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.232 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 10.4 pttp -122.47 69.94 0.98 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.203 -0.935 . . . . 0.0 109.634 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' A' ' 30' ' ' SER . 0.3 OUTLIER 62.18 -84.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.453 -0.779 . . . . 0.0 110.339 179.44 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.496 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 7.9 t -46.1 -42.22 13.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.169 -0.957 . . . . 0.0 110.445 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.789 ' C ' HD23 ' A' ' 27' ' ' LEU . 67.5 mm-40 -56.77 -42.46 79.44 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.906 -1.121 . . . . 0.0 109.146 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.94 HD13 HD12 ' A' ' 60' ' ' LEU . 33.1 mt -60.15 -65.53 0.67 Allowed 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.528 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 2.4 ttpp -40.8 -29.61 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.369 -0.832 . . . . 0.0 109.52 179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -66.81 -58.1 5.72 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.222 -0.924 . . . . 0.0 109.322 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.868 HD21 ' CG1' ' A' ' 13' ' ' VAL . 0.4 OUTLIER -51.8 -29.08 17.66 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.36 -0.837 . . . . 0.0 109.569 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.738 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.0 mp -74.46 -40.02 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.148 -0.97 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.528 ' ND2' ' HG3' ' A' ' 33' ' ' LYS . 73.2 m-80 -90.19 6.1 44.15 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 109.689 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.71 -37.58 5.63 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 109.414 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.521 ' OE1' HD22 ' B' ' 3' ' ' LEU . 1.9 pt-20 -111.76 -25.82 9.28 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.315 -0.866 . . . . 0.0 109.327 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.042 HD22 HD21 ' A' ' 44' ' ' LEU . 89.2 mt -108.28 69.44 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.29 7.44 8.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -130.8 0.01 4.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.219 -0.926 . . . . 0.0 109.643 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.592 ' HB3' HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -119.64 -54.93 2.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.158 -0.964 . . . . 0.0 109.486 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.042 HD21 HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -100.22 25.97 7.0 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.25 -0.906 . . . . 0.0 109.426 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 47' ' ' ILE . 1.4 mt-10 43.1 71.8 0.21 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.307 -0.871 . . . . 0.0 109.581 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.81 ' O ' HD13 ' A' ' 47' ' ' ILE . 3.1 mt-10 52.38 -90.17 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.882 . . . . 0.0 109.255 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.904 HD12 HG21 ' A' ' 53' ' ' VAL . 5.5 mm -133.15 -39.96 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.283 -0.885 . . . . 0.0 109.332 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 85.53 -32.15 0.05 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.814 -0.554 . . . . 0.0 109.767 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.534 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 3.2 mt-10 162.52 64.7 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.193 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.2 OUTLIER 33.45 48.35 0.18 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.247 0.546 . . . . 0.0 110.045 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' OE1' ' C ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -90.05 -62.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.347 -0.846 . . . . 0.0 109.772 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.933 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.6 t -88.35 -14.33 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.072 -1.017 . . . . 0.0 109.92 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.904 HG21 HD12 ' A' ' 47' ' ' ILE . 27.4 t -84.01 -28.43 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.832 -1.167 . . . . 0.0 108.68 179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.69 -33.23 20.11 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.27 -0.894 . . . . 0.0 108.773 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -51.43 7.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.389 -0.82 . . . . 0.0 108.974 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.905 HG22 HD21 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -60.62 -41.87 89.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 O-C-N 121.159 -0.963 . . . . 0.0 108.896 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.77 ' SD ' HD12 ' A' ' 32' ' ' LEU . 7.1 tpt -42.01 -50.02 4.64 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.595 -0.69 . . . . 0.0 109.434 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -43.85 88.28 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.233 -0.917 . . . . 0.0 108.942 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.526 HG21 ' SD ' ' A' ' 79' ' ' MET . 15.8 m -62.23 -23.8 66.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.359 -0.838 . . . . 0.0 109.652 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.94 HD12 HD13 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -85.66 -27.43 25.38 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.13 -0.981 . . . . 0.0 109.275 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.613 ' OD1' ' HE2' ' A' ' 57' ' ' MET . 82.2 m-20 -63.41 114.08 3.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.224 -0.922 . . . . 0.0 109.51 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.4 ' HA ' ' OE2' ' A' ' 72' ' ' GLU . 5.5 t-20 -47.95 -43.08 28.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 109.425 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.99 25.82 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.441 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.16 88.84 2.04 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.11 -34.43 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.2 -1.177 . . . . 0.0 108.622 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 27' ' ' LEU . . . 110.1 -19.02 27.96 Favored Glycine 0 N--CA 1.485 1.947 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.415 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 26.8 mt-10 -73.11 97.4 2.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 109.541 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.53 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 12.9 t -69.79 154.28 42.18 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.198 -0.939 . . . . 0.0 109.619 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.482 ' HB2' ' HG3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -113.32 171.33 7.62 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.806 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.522 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.1 OUTLIER -61.39 -50.13 74.11 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.229 -0.919 . . . . 0.0 110.091 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.548 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 4.4 mp0 -54.83 -40.05 69.2 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.316 -0.865 . . . . 0.0 109.145 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 60' ' ' LEU . 2.4 mt-10 -79.69 -17.82 52.74 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.306 -0.871 . . . . 0.0 109.663 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.743 ' CZ ' HD21 ' B' ' 3' ' ' LEU . 22.1 t80 -69.56 -54.72 12.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.07 -1.019 . . . . 0.0 108.84 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.693 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 1.6 ttm -64.42 -44.4 91.35 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.278 -0.889 . . . . 0.0 108.787 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' ' CE ' ' A' ' 79' ' ' MET . . . -64.04 -25.11 67.97 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.303 -0.873 . . . . 0.0 108.817 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -64.09 -65.72 0.64 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 HD23 ' B' ' 3' ' ' LEU . 39.9 t -61.31 -22.14 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.885 . . . . 0.0 108.95 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.797 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.42 -40.97 89.87 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.365 -0.834 . . . . 0.0 109.341 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.651 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 49.3 mtm -78.02 -66.26 0.87 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.281 -0.887 . . . . 0.0 109.42 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.933 HG13 ' CG1' ' A' ' 52' ' ' VAL . 0.1 OUTLIER -47.48 -22.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 O-C-N 120.474 -1.391 . . . . 0.0 109.462 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.495 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 6.2 m -80.67 -68.0 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.002 -1.061 . . . . 0.0 109.096 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.557 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 3.4 t -75.94 -49.33 18.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.101 -0.999 . . . . 0.0 109.089 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.52 -40.89 0.27 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.707 -0.621 . . . . 0.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 23.4 t -77.4 -42.57 35.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.25 -0.906 . . . . 0.0 109.523 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 82' ' ' THR . 21.8 t-160 -64.44 -11.0 28.85 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.219 -0.926 . . . . 0.0 109.522 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.34 -39.04 21.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.286 -0.884 . . . . 0.0 109.504 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -54.24 -51.41 64.58 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.256 -0.903 . . . . 0.0 109.502 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.44 -24.33 67.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.185 -0.947 . . . . 0.0 109.475 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -49.61 56.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.244 -0.91 . . . . 0.0 109.489 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -179.68 4.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.283 -0.885 . . . . 0.0 109.51 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.97 -1.014 . . . . 0.0 109.453 -179.984 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.526 ' HB2' HG21 ' A' ' 13' ' ' VAL . 2.1 mp0 -72.74 -69.26 0.42 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.423 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.971 HD23 HG21 ' A' ' 77' ' ' VAL . 6.2 mp -65.39 -11.16 39.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.251 -0.905 . . . . 0.0 109.468 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.987 ' O ' HG23 ' B' ' 8' ' ' VAL . 30.9 tt0 -73.83 -62.58 1.45 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.219 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.47 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.2 OUTLIER -65.39 -36.55 84.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.268 -0.895 . . . . 0.0 109.135 179.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.764 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.27 -66.46 0.54 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.308 -0.87 . . . . 0.0 109.433 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.483 ' O ' HG12 ' B' ' 11' ' ' ILE . 0.4 OUTLIER -45.3 -30.81 1.36 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.309 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.987 HG23 ' O ' ' B' ' 4' ' ' GLU . 79.6 t -60.64 -55.61 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.122 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -44.92 87.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.177 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.741 ' CD1' HD23 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -58.76 -26.44 64.01 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.312 -0.868 . . . . 0.0 109.34 179.824 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.927 HD13 ' CZ ' ' B' ' 70' ' ' PHE . 9.0 mm -70.08 -48.29 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.267 -0.895 . . . . 0.0 109.108 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.8 OUTLIER -65.43 -19.03 65.77 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.31 -0.869 . . . . 0.0 109.49 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.559 HG11 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -88.22 -30.85 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.227 -0.92 . . . . 0.0 109.338 -179.944 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.627 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 18.8 t80 -67.91 -46.07 72.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.02 -1.05 . . . . 0.0 109.214 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 53.6 m170 -79.53 -34.24 41.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.242 -0.911 . . . . 0.0 109.64 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 0.2 OUTLIER -62.7 -61.75 2.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 109.455 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.961 ' CG ' HD21 ' B' ' 35' ' ' LEU . 35.9 m-85 -58.19 -44.58 88.14 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.233 -0.917 . . . . 0.0 109.614 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.473 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 83.4 p -67.0 -18.88 65.59 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.565 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.85 13.73 66.61 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.529 ' CD ' ' HA ' ' B' ' 17' ' ' TYR . 0.0 OUTLIER -90.07 -38.24 13.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -1.158 . . . . 0.0 109.435 179.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -166.05 140.36 4.46 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 109.468 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 23' ' ' ASP . . . 84.28 -149.39 24.95 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.452 ' O ' ' O ' ' B' ' 18' ' ' SER . 4.0 p30 -54.75 -169.55 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' B' ' 18' ' ' SER . 4.8 ptpt -134.12 11.85 3.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.407 ' C ' ' HD3' ' B' ' 26' ' ' LYS . 25.4 m-70 -138.27 7.15 2.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 109.595 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.53 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -143.07 170.14 16.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.701 HD23 ' C ' ' B' ' 31' ' ' GLU . 4.2 mp -121.96 139.26 53.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.165 -0.959 . . . . 0.0 110.3 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.523 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 14.7 tttm -86.18 156.95 20.11 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.531 ' HA ' HD12 ' B' ' 32' ' ' LEU . 11.8 mttt -37.46 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.062 -1.023 . . . . 0.0 109.987 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.521 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.5 OUTLIER -79.0 -45.95 19.19 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.701 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.2 OUTLIER -58.47 -40.26 82.22 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 120.808 -1.182 . . . . 0.0 108.776 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.919 HD21 ' SG ' ' B' ' 68' ' ' CYS . 2.6 mt -59.12 -63.4 1.32 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.746 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -39.97 -44.21 1.67 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.514 -0.741 . . . . 0.0 109.871 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -55.46 -61.04 2.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.961 HD21 ' CG ' ' B' ' 17' ' ' TYR . 2.4 mm? -49.29 -58.56 4.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -0.864 . . . . 0.0 109.804 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.982 HD12 HG22 ' B' ' 53' ' ' VAL . 0.7 OUTLIER -43.23 -35.34 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.31 -0.869 . . . . 0.0 109.739 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.498 ' HA ' ' HA ' ' B' ' 43' ' ' PHE . 22.6 m120 -73.67 -54.8 7.28 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 110.142 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' B' ' 38' ' ' ASN . 1.5 m120 -96.29 27.59 3.66 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.171 -0.956 . . . . 0.0 109.579 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.92 ' OE2' HD22 ' A' ' 3' ' ' LEU . 21.5 tt0 -127.79 -37.79 1.92 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.236 -0.915 . . . . 0.0 109.321 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' B' ' 41' ' ' SER . 3.3 mm? -73.02 -56.26 5.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.313 -0.867 . . . . 0.0 109.285 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.531 ' CB ' ' O ' ' B' ' 40' ' ' LEU . 5.4 t 161.34 -56.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.499 -0.75 . . . . 0.0 108.978 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.551 ' C ' ' CG ' ' B' ' 43' ' ' PHE . 2.6 p80 -138.43 56.14 1.73 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.765 ' C ' HD12 ' B' ' 44' ' ' LEU . 0.6 OUTLIER 40.43 34.81 0.25 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.551 -0.718 . . . . 0.0 109.555 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.828 ' N ' HD12 ' B' ' 44' ' ' LEU . 1.3 mp 44.45 -156.85 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.31 -0.868 . . . . 0.0 109.202 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.31 57.89 4.74 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 109.308 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 0.4 OUTLIER 66.74 25.74 9.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.283 -0.886 . . . . 0.0 109.048 -179.718 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.805 HD12 HG23 ' B' ' 53' ' ' VAL . 23.3 mm 62.58 12.18 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.432 -0.793 . . . . 0.0 109.561 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.481 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 42.98 26.2 0.07 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.08 -1.012 . . . . 0.0 109.577 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.481 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 5.4 tt0 75.02 87.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.115 -0.991 . . . . 0.0 109.83 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.478 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 42.39 50.66 4.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.322 -0.861 . . . . 0.0 109.839 179.604 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.491 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.5 tp10 -91.2 -70.57 0.68 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.174 -0.954 . . . . 0.0 109.705 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 1.023 ' CG1' HG13 ' B' ' 80' ' ' VAL . 2.0 t -91.51 -15.04 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.182 -0.949 . . . . 0.0 109.38 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.982 HG22 HD12 ' B' ' 36' ' ' ILE . 62.3 t -84.28 -30.01 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 120.966 -1.084 . . . . 0.0 108.594 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.478 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 10.1 t0 -90.18 -29.08 18.47 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.308 -0.87 . . . . 0.0 108.873 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' B' ' 51' ' ' GLU . 10.5 mtmt -85.27 -47.93 9.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.392 -0.817 . . . . 0.0 109.23 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.918 HG22 HD21 ' B' ' 60' ' ' LEU . 0.6 OUTLIER -65.66 -40.67 88.61 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.124 -0.985 . . . . 0.0 109.006 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.84 ' SD ' HD13 ' B' ' 32' ' ' LEU . 8.0 tpt -39.9 -52.53 2.39 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.763 -0.586 . . . . 0.0 109.723 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.73 -42.27 96.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.196 -0.94 . . . . 0.0 108.863 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.409 ' N ' ' O ' ' B' ' 56' ' ' VAL . 96.6 m -62.22 -20.51 64.28 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.363 -0.836 . . . . 0.0 109.799 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.918 HD21 HG22 ' B' ' 56' ' ' VAL . 0.3 OUTLIER -85.33 -73.62 0.43 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.041 -1.037 . . . . 0.0 109.189 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.46 ' HA ' ' OE1' ' B' ' 72' ' ' GLU . 9.8 t70 -84.64 93.12 8.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.28 -0.888 . . . . 0.0 109.547 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -101.29 10.74 40.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.907 . . . . 0.0 109.369 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -92.43 -41.84 10.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 109.558 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.08 90.05 2.1 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -172.87 -37.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.293 -1.122 . . . . 0.0 108.463 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.79 32.88 3.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 5.2 mt-10 -144.9 113.11 6.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.255 -1.144 . . . . 0.0 109.361 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.919 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.86 151.18 46.0 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.202 -0.936 . . . . 0.0 109.904 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.497 ' HB3' ' HG3' ' B' ' 72' ' ' GLU . 4.5 t70 -112.46 171.29 7.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -0.856 . . . . 0.0 108.724 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.927 ' CZ ' HD13 ' B' ' 11' ' ' ILE . 0.2 OUTLIER -54.36 -53.0 59.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.225 -0.922 . . . . 0.0 110.491 -179.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.425 ' OE1' ' OD2' ' B' ' 69' ' ' ASP . 0.0 OUTLIER -56.61 -26.65 56.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.151 -0.968 . . . . 0.0 109.269 -179.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' B' ' 69' ' ' ASP . 6.5 mt-10 -85.58 -22.66 27.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 109.831 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.539 ' CZ ' ' HG ' ' B' ' 35' ' ' LEU . 50.8 t80 -74.28 -40.41 62.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.09 -1.006 . . . . 0.0 108.943 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.797 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -75.6 -41.12 55.33 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.48 -0.762 . . . . 0.0 109.196 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.452 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -65.21 -30.95 71.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.15 -0.969 . . . . 0.0 108.861 179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.691 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -66.08 -63.37 1.1 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.449 -0.782 . . . . 0.0 108.944 179.691 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.564 ' N ' ' CG ' ' B' ' 76' ' ' PHE . 52.2 t -57.83 -26.78 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.189 -0.944 . . . . 0.0 109.351 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.693 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -67.09 -34.49 77.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.345 -0.847 . . . . 0.0 109.472 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.652 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 0.3 OUTLIER -82.86 -69.4 0.63 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 109.659 -179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 1.023 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -45.88 -23.78 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 120.549 -1.345 . . . . 0.0 109.334 -179.413 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' B' ' 77' ' ' VAL . 12.0 m -78.42 -67.74 0.71 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.561 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.0 t -78.22 -49.54 13.57 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.136 -0.977 . . . . 0.0 108.874 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.652 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.83 -36.38 0.11 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.769 -0.582 . . . . 0.0 109.82 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.402 ' N ' ' O ' ' B' ' 82' ' ' THR . 2.3 t -90.03 -36.94 14.63 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.202 -0.936 . . . . 0.0 109.438 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.509 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 60.3 t60 -62.33 -12.95 23.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.95 -31.3 23.66 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.2 -0.938 . . . . 0.0 109.406 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -55.34 5.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -90.05 -43.98 10.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.271 -0.893 . . . . 0.0 109.511 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' B' ' 85' ' ' HIS . 2.6 tm-20 -60.02 131.46 50.93 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.235 -0.915 . . . . 0.0 109.511 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.424 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 7.6 t60 69.37 124.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.458 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.437 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 16.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.518 ' HG2' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -74.31 -77.54 0.11 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.457 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.713 HD13 ' HG2' ' B' ' 39' ' ' GLU . 7.3 mp -66.91 -15.53 63.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.447 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.783 ' O ' HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -73.65 -63.02 1.29 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.378 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.449 ' O ' ' HD2' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -63.08 -34.18 77.04 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.249 -0.907 . . . . 0.0 109.356 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.518 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -66.44 -66.92 0.49 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.327 -0.858 . . . . 0.0 109.549 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.618 ' O ' HD12 ' A' ' 11' ' ' ILE . 6.8 ptm -43.93 -31.78 0.96 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 ' O ' ' A' ' 4' ' ' GLU . 71.5 t -62.4 -55.65 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.513 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.862 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -63.42 -57.72 9.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.504 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.148 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -44.04 -37.96 3.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 109.372 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.618 HD12 ' O ' ' A' ' 7' ' ' MET . 32.9 mt -64.64 -45.8 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.937 . . . . 0.0 109.36 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -58.27 -23.68 56.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.282 -0.886 . . . . 0.0 109.302 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 35' ' ' LEU . 0.9 OUTLIER -83.47 -38.6 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.264 -0.898 . . . . 0.0 109.398 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.0 t80 -59.56 -51.96 67.58 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 120.92 -1.112 . . . . 0.0 109.425 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -67.37 -55.16 14.88 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.562 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -46.09 -69.47 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.221 -0.924 . . . . 0.0 109.605 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.58 ' CE1' ' HG ' ' A' ' 35' ' ' LEU . 41.3 m-85 -50.2 -27.67 6.31 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.248 -0.908 . . . . 0.0 109.561 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.484 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -62.52 -44.9 95.22 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 109.427 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' A' ' 24' ' ' LYS . . . -55.27 -18.52 14.05 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 27.8 mmm180 -68.14 -41.87 81.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.308 -1.113 . . . . 0.0 109.419 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.568 ' CG ' ' CD ' ' A' ' 28' ' ' LYS . 2.7 tm-20 -82.23 161.24 22.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.318 -0.864 . . . . 0.0 109.433 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -45.52 -51.04 10.11 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -94.97 167.33 11.47 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.232 -1.158 . . . . 0.0 109.402 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.526 ' CG ' ' HA2' ' A' ' 19' ' ' GLY . 11.4 mttt -118.13 86.96 2.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.294 -0.879 . . . . 0.0 109.522 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 1.9 t-80 -170.08 -35.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.243 -0.911 . . . . 0.0 109.624 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 5.7 mtmt -140.05 170.11 16.45 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 ' HB3' ' A' ' 31' ' ' GLU . 82.5 mt -107.05 170.09 8.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.284 -0.885 . . . . 0.0 109.497 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.568 ' CD ' ' CG ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -128.97 73.59 1.52 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.141 -0.974 . . . . 0.0 109.917 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.853 ' HA ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttmt 62.35 -84.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.442 -0.786 . . . . 0.0 110.696 179.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.467 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 0.8 OUTLIER -43.81 -50.53 7.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.115 -0.991 . . . . 0.0 110.567 -179.058 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.772 ' HB3' HD22 ' A' ' 27' ' ' LEU . 6.1 mm-40 -52.69 -40.89 63.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.972 -1.08 . . . . 0.0 109.513 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 29' ' ' LYS . 14.2 mt -58.92 -65.89 0.59 Allowed 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.623 -0.673 . . . . 0.0 109.631 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.52 ' CA ' HG13 ' A' ' 36' ' ' ILE . 7.1 ttpp -38.47 -37.64 0.32 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.578 -0.701 . . . . 0.0 110.016 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.448 ' O ' ' OD1' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -65.9 -50.29 65.0 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.198 -0.939 . . . . 0.0 109.474 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 13' ' ' VAL . 1.3 mt -60.93 -21.53 63.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.287 -0.883 . . . . 0.0 109.783 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.909 ' CD1' HG13 ' A' ' 53' ' ' VAL . 0.5 OUTLIER -78.25 -57.97 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.166 -0.959 . . . . 0.0 109.575 -179.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.467 ' OD1' ' HA ' ' A' ' 43' ' ' PHE . 70.3 m-80 -70.1 -5.18 25.1 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.19 -0.944 . . . . 0.0 109.67 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 34' ' ' GLU . 6.5 m120 -114.39 -8.75 12.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.186 -0.946 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.768 ' OE2' HG13 ' A' ' 77' ' ' VAL . 1.8 tm-20 -94.25 -46.91 6.86 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.175 -0.953 . . . . 0.0 109.584 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.669 HD22 ' N ' ' A' ' 40' ' ' LEU . 2.9 mm? -72.9 -52.35 15.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.215 -0.928 . . . . 0.0 109.555 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.428 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER 170.08 -60.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.155 -0.965 . . . . 0.0 109.656 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.457 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 68.6 m-70 -136.1 -57.86 0.76 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.192 -0.943 . . . . 0.0 109.459 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.857 ' C ' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -160.16 28.78 0.17 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.285 -0.885 . . . . 0.0 109.493 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.937 HD22 HG12 ' A' ' 80' ' ' VAL . 0.9 OUTLIER 46.39 -148.33 0.13 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 109.377 179.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.482 ' OE1' ' HG2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -48.68 -49.32 38.2 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.228 -0.92 . . . . 0.0 109.265 179.804 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.482 ' HG2' ' OE1' ' A' ' 45' ' ' GLU . 6.3 pt-20 167.78 88.18 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.907 HD11 HD13 ' A' ' 44' ' ' LEU . 6.1 mt -82.05 72.37 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.271 -0.893 . . . . 0.0 109.238 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 49' ' ' GLU . 0.1 OUTLIER -42.5 -34.79 0.9 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.355 -0.841 . . . . 0.0 109.444 179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' A' ' 50' ' ' GLN . 14.1 pt-20 178.37 -31.72 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.449 -0.782 . . . . 0.0 109.262 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 1.2 pt20 -159.72 29.98 0.19 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.266 -0.896 . . . . 0.0 109.759 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.473 ' OE1' ' HG3' ' A' ' 46' ' ' GLU . 1.8 mt-10 -60.79 -70.86 0.16 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.033 -1.042 . . . . 0.0 108.802 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.836 HG11 ' HA ' ' A' ' 80' ' ' VAL . 2.5 t -90.96 -12.72 9.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.909 HG13 ' CD1' ' A' ' 36' ' ' ILE . 0.7 OUTLIER -76.91 -30.27 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 22.6 t70 -76.24 -47.18 24.85 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.278 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -50.54 63.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.296 -0.878 . . . . 0.0 109.394 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 1.013 HG11 HG22 ' A' ' 80' ' ' VAL . 24.0 m -57.78 -47.31 86.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.114 -0.991 . . . . 0.0 109.58 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.602 ' N ' HG23 ' A' ' 56' ' ' VAL . 9.9 tpt -38.21 -49.55 1.37 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.576 -0.702 . . . . 0.0 110.349 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -60.02 -46.1 90.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.12 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 59' ' ' THR . 28.6 m -73.18 -8.76 57.21 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.443 -0.786 . . . . 0.0 109.856 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.656 ' N ' HD23 ' A' ' 60' ' ' LEU . 1.9 mt -84.78 -27.68 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.166 -0.959 . . . . 0.0 109.324 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -43.73 110.16 0.19 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.537 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.521 ' CB ' ' OD1' ' A' ' 69' ' ' ASP . 33.2 t30 -60.1 -52.05 67.0 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.3 -0.875 . . . . 0.0 109.42 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -152.57 18.12 0.62 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.224 -0.922 . . . . 0.0 109.519 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.79 88.53 1.77 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.28 -36.66 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.301 -1.117 . . . . 0.0 108.525 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.2 -1.23 31.26 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -99.83 121.7 41.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.213 -1.169 . . . . 0.0 109.483 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.647 ' CB ' HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -69.51 131.28 44.47 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.521 ' OD1' ' CB ' ' A' ' 62' ' ' ASN . 2.2 m-20 -110.27 170.66 7.93 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.579 ' CG ' ' OG1' ' B' ' 82' ' ' THR . 1.2 t80 -52.96 -50.63 63.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.071 -1.018 . . . . 0.0 110.406 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.482 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 10.2 mt-30 -51.92 -46.48 64.66 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.501 -0.749 . . . . 0.0 109.752 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' HA ' ' A' ' 68' ' ' CYS . 0.5 OUTLIER -74.38 -18.6 60.65 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.095 -1.003 . . . . 0.0 109.695 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 1.148 ' CE2' HD23 ' A' ' 10' ' ' LEU . 10.5 t80 -63.17 -53.95 45.31 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.045 -1.034 . . . . 0.0 109.235 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.899 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -69.69 -46.21 66.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.975 ' CB ' ' HB2' ' B' ' 75' ' ' ALA . . . -56.18 -31.54 63.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.038 -1.039 . . . . 0.0 109.04 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.787 ' CE2' HG23 ' A' ' 77' ' ' VAL . 0.0 OUTLIER -64.6 -65.05 0.73 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.787 HG23 ' CE2' ' A' ' 76' ' ' PHE . 41.3 t -56.55 -18.71 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.881 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -65.46 -48.92 71.0 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.353 -0.842 . . . . 0.0 109.331 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.9 OUTLIER -74.98 -64.16 1.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.354 -0.841 . . . . 0.0 109.745 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 1.013 HG22 HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -48.01 -22.01 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 O-C-N 120.407 -1.433 . . . . 0.0 109.627 -178.824 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.715 ' CG2' HD11 ' B' ' 11' ' ' ILE . 4.6 m -80.62 -65.8 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.91 -1.119 . . . . 0.0 108.876 178.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.7 t -80.1 -49.7 11.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.158 -0.963 . . . . 0.0 108.922 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.68 -33.77 0.08 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.607 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.466 ' SG ' ' HG2' ' A' ' 45' ' ' GLU . 11.9 t -74.17 -50.89 17.34 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.354 -0.841 . . . . 0.0 109.351 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 -53.44 -55.69 23.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.922 . . . . 0.0 109.45 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.09 -38.55 83.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.229 -0.919 . . . . 0.0 109.471 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -44.64 -33.36 1.78 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -76.63 -40.69 48.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.229 -0.92 . . . . 0.0 109.533 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.22 161.52 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.921 . . . . 0.0 109.483 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 -131.56 175.91 8.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 109.502 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.061 -0.971 . . . . 0.0 109.429 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.862 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -58.25 -75.13 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.254 -0.903 . . . . 0.0 109.66 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.807 HD21 ' HZ ' ' A' ' 73' ' ' PHE . 1.3 mt -75.58 -30.6 59.69 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.157 -0.964 . . . . 0.0 109.651 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 7' ' ' MET . 16.9 mt-10 -57.36 -59.1 5.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -0.954 . . . . 0.0 109.301 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' B' ' 1' ' ' SER . 1.0 OUTLIER -60.71 -49.66 76.61 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.291 -0.881 . . . . 0.0 109.378 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.562 ' HB1' HD12 ' A' ' 10' ' ' LEU . . . -66.0 -9.83 33.99 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.274 -0.891 . . . . 0.0 109.449 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' B' ' 3' ' ' LEU . 2.6 ttp -80.71 -53.84 6.16 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.436 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.97 -36.44 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.373 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.12 -46.72 64.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.203 -0.936 . . . . 0.0 109.469 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.587 ' HB3' ' HE1' ' B' ' 74' ' ' MET . 6.3 mt -61.3 -66.84 0.47 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.256 -0.903 . . . . 0.0 109.427 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.715 HD11 ' CG2' ' A' ' 81' ' ' THR . 61.3 mt -41.76 -40.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.402 -0.811 . . . . 0.0 109.327 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' CG ' ' B' ' 16' ' ' GLN . 29.7 t70 -58.59 -54.06 51.37 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.26 -0.9 . . . . 0.0 109.066 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.692 HG21 HD13 ' A' ' 3' ' ' LEU . 1.7 t -51.5 -25.94 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.375 -0.828 . . . . 0.0 109.504 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.58 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 10.0 t80 -72.08 -46.39 57.0 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.897 -1.127 . . . . 0.0 109.666 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.522 ' NE2' ' HD3' ' B' ' 24' ' ' LYS . 43.9 t-80 -78.04 -14.68 59.42 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.262 -0.899 . . . . 0.0 110.454 -179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.525 ' O ' ' CG ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -90.41 -60.16 2.0 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.947 -1.096 . . . . 0.0 109.287 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.579 ' CD2' ' OE1' ' B' ' 34' ' ' GLU . 24.6 m-85 -61.63 -33.23 73.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.522 -0.736 . . . . 0.0 109.623 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.531 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 4.2 p -82.87 -11.35 58.28 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.172 -0.955 . . . . 0.0 109.658 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' B' ' 24' ' ' LYS . . . -102.77 9.31 55.26 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.525 ' CG ' ' O ' ' B' ' 16' ' ' GLN . 11.0 mtp85 -89.98 -33.95 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -1.159 . . . . 0.0 109.476 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.476 ' HG2' ' OE2' ' B' ' 31' ' ' GLU . 5.6 pt-20 -170.17 117.44 0.55 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.905 . . . . 0.0 109.384 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.54 -81.13 0.23 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' B' ' 24' ' ' LYS . 3.2 p30 -171.57 28.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -1.147 . . . . 0.0 109.555 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.522 ' HD3' ' NE2' ' B' ' 15' ' ' HIS . 1.6 ttmt 43.65 61.2 2.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.272 -0.893 . . . . 0.0 109.508 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.508 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.2 OUTLIER -170.1 -34.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.287 -0.883 . . . . 0.0 109.678 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.531 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.0 OUTLIER -141.12 165.25 28.05 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.203 -0.935 . . . . 0.0 109.708 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 1.08 HD12 HD23 ' B' ' 32' ' ' LEU . 17.8 mt -87.77 148.76 24.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.303 -0.873 . . . . 0.0 109.262 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -116.55 72.64 0.82 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.688 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' B' ' 28' ' ' LYS . 0.0 OUTLIER 62.32 -85.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.461 -0.775 . . . . 0.0 110.578 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' B' ' 34' ' ' GLU . 0.3 OUTLIER -48.32 -37.52 16.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.197 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.665 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.9 mm-40 -58.27 -41.22 83.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.085 -1.009 . . . . 0.0 109.48 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 1.08 HD23 HD12 ' B' ' 27' ' ' LEU . 18.8 mt -64.46 -57.13 10.11 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.524 -0.735 . . . . 0.0 109.496 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 1.127 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.89 -68.78 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.252 -0.905 . . . . 0.0 110.055 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.579 ' OE1' ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -42.74 -49.82 5.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.187 -0.946 . . . . 0.0 109.779 -179.421 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.831 HD23 ' CE2' ' B' ' 76' ' ' PHE . 14.1 tp -49.12 -47.54 45.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.004 -1.06 . . . . 0.0 109.555 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.961 HD13 HG22 ' B' ' 53' ' ' VAL . 2.9 mt -63.84 -32.66 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.578 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' GLU . 9.2 m120 -94.46 -77.33 0.46 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.021 -1.05 . . . . 0.0 109.731 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.418 ' C ' ' O ' ' B' ' 37' ' ' ASN . 5.0 t-20 -42.68 -26.42 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.329 -0.857 . . . . 0.0 109.902 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.713 ' HG2' HD13 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -109.31 -46.24 3.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.084 -1.01 . . . . 0.0 109.922 -179.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.724 HD23 ' CD1' ' B' ' 44' ' ' LEU . 0.7 OUTLIER -104.89 61.65 0.7 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.065 -1.022 . . . . 0.0 109.503 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.2 30.01 7.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.239 -0.913 . . . . 0.0 109.486 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.59 ' CD2' ' HG3' ' A' ' 4' ' ' GLU . 86.4 m-70 -109.82 -72.03 0.74 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.233 -0.917 . . . . 0.0 109.458 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.47 ' O ' ' CG ' ' B' ' 43' ' ' PHE . 68.6 t80 -86.11 -5.83 59.13 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.198 -0.939 . . . . 0.0 109.583 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.724 ' CD1' HD23 ' B' ' 40' ' ' LEU . 5.8 mp -102.17 92.91 4.95 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.27 -0.894 . . . . 0.0 109.441 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -57.0 89.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.224 -0.923 . . . . 0.0 109.463 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.46 ' O ' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER 45.4 -170.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.183 -0.948 . . . . 0.0 109.406 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 1.001 HD13 HG21 ' B' ' 53' ' ' VAL . 29.7 mt -98.43 -19.04 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.215 -0.928 . . . . 0.0 109.443 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 83.1 -42.73 0.1 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.686 -0.634 . . . . 0.0 109.725 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.0 OUTLIER 179.55 -44.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.139 -0.976 . . . . 0.0 109.203 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.521 ' CB ' ' O ' ' B' ' 49' ' ' GLU . 0.6 OUTLIER 162.36 58.52 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.362 -0.836 . . . . 0.0 109.243 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -90.42 -70.35 0.68 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.201 -0.937 . . . . 0.0 109.899 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.816 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.7 t -87.64 -20.89 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.094 -1.004 . . . . 0.0 109.601 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.127 HG11 ' CD ' ' B' ' 33' ' ' LYS . 54.7 t -76.9 -29.59 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.955 -1.091 . . . . 0.0 109.224 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.3 OUTLIER -90.11 -29.55 18.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.259 -0.901 . . . . 0.0 109.546 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.41 -35.18 35.54 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.632 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 52' ' ' VAL . 11.1 m -58.63 -47.08 89.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 O-C-N 121.13 -0.981 . . . . 0.0 109.919 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' B' ' 57' ' ' MET . 8.2 tpp -42.01 -28.33 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.014 -1.054 . . . . 0.0 109.14 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' B' ' 56' ' ' VAL . 1.7 mp0 -80.71 -45.39 17.19 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.457 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.6 m -73.53 -67.21 0.61 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.405 -0.809 . . . . 0.0 109.39 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.973 HD22 ' HB2' ' B' ' 76' ' ' PHE . 2.6 mt -40.61 -33.87 0.31 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.481 -0.762 . . . . 0.0 109.341 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 57' ' ' MET . 4.7 t0 -90.17 83.95 6.06 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.419 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -96.1 26.92 3.9 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.266 -0.896 . . . . 0.0 109.577 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.448 ' OD2' ' OD2' ' B' ' 69' ' ' ASP . 13.1 m-20 -127.93 -34.17 2.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 109.5 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.15 91.47 1.34 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 177.04 -32.71 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.219 -1.165 . . . . 0.0 108.669 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.13 26.49 4.9 Favored Glycine 0 N--CA 1.486 2.012 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' B' ' 26' ' ' LYS . 23.8 pt-20 -136.43 124.46 22.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.236 -1.155 . . . . 0.0 109.374 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.866 ' SG ' HD21 ' B' ' 32' ' ' LEU . 12.8 m -69.57 166.05 19.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.188 -0.945 . . . . 0.0 110.009 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.6 OUTLIER -129.21 172.23 11.66 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.549 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.1 OUTLIER -61.27 -52.66 63.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.489 -179.555 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.439 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.8 OUTLIER -56.34 -34.77 66.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.133 -0.98 . . . . 0.0 109.225 -179.588 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.535 ' CA ' ' OE1' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -81.49 -20.2 40.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.879 . . . . 0.0 108.877 179.561 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.613 ' CE1' HG12 ' B' ' 13' ' ' VAL . 3.9 t80 -65.7 -51.04 62.53 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.881 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -69.11 -46.15 68.41 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.279 -0.888 . . . . 0.0 108.902 179.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.975 ' HB2' ' CB ' ' A' ' 75' ' ' ALA . . . -64.74 -18.13 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.171 -0.956 . . . . 0.0 108.87 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.973 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -72.62 -62.78 1.33 Allowed 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.662 ' O ' HG23 ' B' ' 81' ' ' THR . 96.1 t -60.56 -27.58 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.899 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -69.26 -30.58 68.73 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.584 -0.697 . . . . 0.0 109.229 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.71 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 2.4 mmm -76.28 -71.05 0.41 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.17 -0.956 . . . . 0.0 108.643 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.753 HG11 HG12 ' B' ' 36' ' ' ILE . 0.0 OUTLIER -44.6 -24.99 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.866 0 O-C-N 120.66 -1.275 . . . . 0.0 109.467 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.662 HG23 ' O ' ' B' ' 77' ' ' VAL . 4.9 p -75.38 -69.61 0.47 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.06 -1.025 . . . . 0.0 108.547 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.579 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 1.2 m -78.01 -53.6 7.24 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -35.96 -37.04 0.1 Allowed 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.257 0.551 . . . . 0.0 109.851 179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' B' ' 82' ' ' THR . 5.2 t -88.2 -38.68 15.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.272 -0.892 . . . . 0.0 109.533 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' B' ' 82' ' ' THR . 3.2 t-160 -55.41 -21.23 14.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.479 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -87.59 -37.93 16.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.923 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.0 -20.29 3.32 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.47 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.15 -69.88 0.1 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.221 -0.924 . . . . 0.0 109.41 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.84 122.97 10.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.279 -0.888 . . . . 0.0 109.456 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -171.69 1.89 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 109.485 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.478 ' OXT' ' CG ' ' B' ' 91' ' ' GLU . 1.5 pt-20 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.468 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.43 ' HB3' ' HB2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.95 ' HB3' ' HB1' ' B' ' 9' ' ' ALA . 1.9 mp0 -67.17 -73.01 0.15 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.216 -0.927 . . . . 0.0 109.455 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.672 HD21 HD23 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -44.52 -29.73 0.77 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.48 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 1' ' ' SER . 1.0 OUTLIER -65.72 -52.84 48.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.217 -0.927 . . . . 0.0 109.654 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -62.21 -26.1 68.17 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.209 -0.932 . . . . 0.0 109.494 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.65 ' HA ' ' HB2' ' B' ' 6' ' ' ALA . . . -72.94 -24.41 60.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.515 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' B' ' 81' ' ' THR . 6.8 tpt -80.86 -55.84 4.53 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.434 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.9 p -60.97 -24.39 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.195 -0.941 . . . . 0.0 109.614 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.756 ' HB1' ' CA ' ' B' ' 2' ' ' GLU . . . -77.43 -66.64 0.81 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.558 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.872 HD13 HD22 ' B' ' 3' ' ' LEU . 4.1 mm? -43.82 -50.37 7.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.249 -0.907 . . . . 0.0 109.687 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.588 HG23 ' N ' ' A' ' 12' ' ' ASP . 17.9 tt -57.61 -45.61 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 109.604 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.588 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -57.07 -25.72 59.18 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.27 -0.894 . . . . 0.0 109.865 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.068 ' CG1' HD11 ' A' ' 35' ' ' LEU . 2.7 t -87.08 -28.15 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.1 -1.0 . . . . 0.0 109.725 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 7.1 t80 -66.3 -50.18 64.52 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.919 -1.113 . . . . 0.0 109.389 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -79.33 -31.99 43.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.25 -0.906 . . . . 0.0 109.684 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.4 tt0 -66.22 -65.59 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 109.544 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.559 ' CD1' HG13 ' A' ' 13' ' ' VAL . 19.7 m-85 -56.9 -45.0 82.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.31 -0.869 . . . . 0.0 109.604 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 18.1 m -67.8 -20.55 65.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.179 -0.951 . . . . 0.0 109.56 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.85 -7.79 76.19 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.438 ' HD2' ' HA ' ' A' ' 17' ' ' TYR . 23.8 mtp180 -70.68 -64.47 0.89 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -1.146 . . . . 0.0 109.482 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.37 170.05 11.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.278 -0.889 . . . . 0.0 109.438 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.536 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . -62.03 88.05 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER 162.07 89.99 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.379 -1.071 . . . . 0.0 109.307 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.42 35.14 0.76 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.259 -0.901 . . . . 0.0 109.672 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -151.13 16.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.191 -0.943 . . . . 0.0 109.682 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.1 OUTLIER -170.31 168.25 8.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.124 -0.985 . . . . 0.0 109.579 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.884 HD22 ' HB3' ' A' ' 31' ' ' GLU . 89.2 mt -120.0 149.99 41.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.437 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 30' ' ' SER . 0.1 OUTLIER -105.33 94.27 5.13 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 -179.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HA ' ' SD ' ' A' ' 57' ' ' MET . 2.0 ttmt 37.01 -84.6 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.703 -0.623 . . . . 0.0 111.276 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.613 ' N ' ' O ' ' A' ' 28' ' ' LYS . 1.8 m -45.18 -46.96 12.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.916 -1.115 . . . . 0.0 109.919 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.884 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -45.38 -46.9 13.45 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.036 -1.04 . . . . 0.0 109.32 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.018 ' CD2' HD22 ' A' ' 60' ' ' LEU . 2.5 mp -60.81 -60.95 2.98 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.592 -0.692 . . . . 0.0 109.247 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.945 ' CD ' HG11 ' A' ' 53' ' ' VAL . 1.2 mmmm -38.93 -36.43 0.28 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.508 -0.745 . . . . 0.0 109.748 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -68.44 -61.49 1.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.111 -0.993 . . . . 0.0 109.255 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.068 HD11 ' CG1' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -41.41 -51.52 3.73 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.697 . . . . 0.0 109.882 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.051 HD13 HG22 ' A' ' 53' ' ' VAL . 53.9 mt -60.61 -50.94 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 110.435 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.558 ' ND2' ' N ' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -81.75 12.04 4.3 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.972 -1.08 . . . . 0.0 109.955 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.46 ' O ' ' OE1' ' A' ' 39' ' ' GLU . 1.4 t-20 -140.83 12.17 2.26 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.776 ' CB ' HD12 ' B' ' 3' ' ' LEU . 6.8 mm-40 -151.55 -35.7 0.13 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.007 -1.058 . . . . 0.0 110.459 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.042 HD23 ' HA ' ' A' ' 36' ' ' ILE . 2.1 mm? -44.22 -74.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.018 -1.051 . . . . 0.0 109.432 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.576 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 2.1 p 156.02 -86.35 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.419 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -153.12 -39.15 0.1 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.484 -0.76 . . . . 0.0 109.081 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.486 ' HB2' HD23 ' A' ' 44' ' ' LEU . 85.8 m-85 -43.68 -34.47 1.49 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.344 -0.847 . . . . 0.0 109.358 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.957 HD13 HG12 ' A' ' 80' ' ' VAL . 0.5 OUTLIER -147.21 83.01 1.56 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.684 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.516 ' O ' ' CB ' ' A' ' 46' ' ' GLU . 3.1 pp20? -117.83 136.6 53.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.352 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' CB ' ' O ' ' A' ' 45' ' ' GLU . 15.0 tt0 77.99 -3.98 2.28 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.344 -0.848 . . . . 0.0 109.691 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.92 HG13 HG21 ' A' ' 53' ' ' VAL . 3.3 mm 51.61 101.36 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.272 -0.892 . . . . 0.0 109.683 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -44.12 -33.27 1.44 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.501 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' A' ' 50' ' ' GLN . 15.7 tt0 -179.85 68.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.522 ' HA ' HG21 ' A' ' 47' ' ' ILE . 2.9 mt-30 43.85 56.51 4.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.506 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.14 -69.98 0.69 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.244 -0.91 . . . . 0.0 109.523 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.865 ' CG1' HG13 ' A' ' 80' ' ' VAL . 1.9 t -89.24 -12.35 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.188 -0.945 . . . . 0.0 109.534 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.051 HG22 HD13 ' A' ' 36' ' ' ILE . 95.0 t -82.52 -26.26 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.123 -0.985 . . . . 0.0 109.17 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -87.49 -36.55 17.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.136 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.88 -47.29 15.33 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.378 -0.826 . . . . 0.0 109.209 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.859 ' O ' HD12 ' A' ' 60' ' ' LEU . 1.5 p -62.96 -43.41 99.0 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 O-C-N 121.194 -0.941 . . . . 0.0 109.253 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.502 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -46.09 -42.36 13.5 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.45 179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -57.62 12.15 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 56' ' ' VAL . 6.0 t -63.6 -12.91 37.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.231 -0.918 . . . . 0.0 109.616 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.018 HD22 ' CD2' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -79.77 -30.04 40.61 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -0.858 . . . . 0.0 109.452 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 61' ' ' ASP . 0.5 OUTLIER -89.92 104.73 17.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -99.94 1.14 42.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.286 -0.884 . . . . 0.0 109.585 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -120.91 -22.49 6.19 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.933 . . . . 0.0 109.527 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 85.78 99.21 0.74 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER 167.34 -27.52 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.272 -1.134 . . . . 0.0 108.622 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.42 -14.59 30.28 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.402 ' OE2' ' N ' ' A' ' 67' ' ' GLU . 2.7 mm-40 -79.61 111.42 15.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -1.097 . . . . 0.0 109.31 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 16.4 t -69.68 156.55 38.79 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.88 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.508 ' CB ' ' HG2' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -118.57 171.83 7.91 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.418 -0.801 . . . . 0.0 108.843 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.541 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.1 OUTLIER -62.63 -51.54 66.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.17 -0.956 . . . . 0.0 110.194 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.451 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.7 mt-30 -56.03 -33.1 64.62 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 0.0 109.062 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.508 ' HG2' ' CB ' ' A' ' 69' ' ' ASP . 1.1 mm-40 -81.79 -22.12 37.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.388 -0.82 . . . . 0.0 109.02 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.448 ' CE2' HD12 ' A' ' 10' ' ' LEU . 37.9 t80 -66.78 -58.03 5.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.393 -0.817 . . . . 0.0 109.1 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 1.045 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 4.1 tpt -64.35 -47.96 77.35 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.279 -0.888 . . . . 0.0 109.153 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.834 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -57.05 -29.48 63.46 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.157 -0.964 . . . . 0.0 108.686 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.791 ' CD2' HG23 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -62.0 -66.19 0.58 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.488 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.791 HG23 ' CD2' ' A' ' 76' ' ' PHE . 55.1 t -55.52 -22.2 11.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -59.79 -49.16 78.79 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.513 -0.742 . . . . 0.0 109.154 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.69 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 20.3 mtp -76.64 -65.67 0.91 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.84 0.829 . . . . 0.0 109.664 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.957 HG12 HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -47.64 -21.74 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 120.449 -1.407 . . . . 0.0 110.108 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 21.9 m -83.49 -63.56 1.33 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.714 -1.241 . . . . 0.0 108.612 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.586 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.3 m -79.62 -53.13 7.14 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.26 -33.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.2 0.524 . . . . 0.0 109.946 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 82' ' ' THR . 10.6 t -89.54 -41.96 11.71 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.476 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.429 ' N ' ' O ' ' A' ' 82' ' ' THR . 13.8 m170 -50.88 -56.44 12.27 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 109.47 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 1.4 tt0 -67.36 -19.47 65.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.912 . . . . 0.0 109.455 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 84' ' ' CYS . 36.7 t80 -46.09 -48.69 17.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.267 -0.895 . . . . 0.0 109.476 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.446 ' O ' ' O ' ' A' ' 89' ' ' GLU . 1.2 m-85 -48.94 -48.23 42.99 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.224 -0.923 . . . . 0.0 109.468 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mm-40 60.55 148.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 109.437 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.5 ' N ' ' ND1' ' A' ' 90' ' ' HIS . 0.0 OUTLIER -51.74 93.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.239 -0.913 . . . . 0.0 109.433 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 89' ' ' GLU . 2.9 tt0 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 117.985 -1.007 . . . . 0.0 109.5 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.485 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 20.4 m . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.756 ' CA ' ' HB1' ' A' ' 9' ' ' ALA . 3.8 mm-40 -73.08 -55.12 6.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 109.257 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.876 HD11 HD21 ' A' ' 35' ' ' LEU . 2.8 mt -76.51 -11.52 59.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.847 . . . . 0.0 109.418 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 7' ' ' MET . 0.1 OUTLIER -74.61 -54.57 7.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.192 -0.942 . . . . 0.0 108.815 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -20.01 58.79 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.303 -0.873 . . . . 0.0 109.068 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.65 ' HB2' ' HA ' ' A' ' 6' ' ' ALA . . . -81.96 -30.47 31.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.388 -0.82 . . . . 0.0 109.568 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' B' ' 4' ' ' GLU . 1.3 ppp? -80.32 -32.01 38.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.133 -0.979 . . . . 0.0 109.392 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.428 ' N ' ' HG3' ' B' ' 7' ' ' MET . 55.4 t -73.09 -49.13 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.127 -0.983 . . . . 0.0 109.17 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.95 ' HB1' ' HB3' ' A' ' 2' ' ' GLU . . . -69.11 -43.91 73.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.346 -0.846 . . . . 0.0 109.613 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.657 HD21 HD23 ' A' ' 3' ' ' LEU . 50.0 mt -61.96 -28.3 69.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.209 -0.932 . . . . 0.0 109.802 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.958 HD13 ' CE2' ' B' ' 70' ' ' PHE . 5.2 mm -72.16 -43.45 66.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.374 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 1.3 t70 -67.8 -36.9 81.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.293 -0.88 . . . . 0.0 110.161 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.901 HG13 ' O ' ' B' ' 9' ' ' ALA . 1.3 m -75.03 -34.48 32.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.046 -1.034 . . . . 0.0 110.083 -179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.694 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 69.5 t80 -61.76 -52.23 65.07 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 120.685 -1.26 . . . . 0.0 109.234 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.429 ' O ' ' C ' ' B' ' 16' ' ' GLN . 29.1 m80 -74.71 -60.46 2.27 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.25 -0.906 . . . . 0.0 109.755 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 2.3 tt0 -42.73 -47.21 5.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.287 -0.883 . . . . 0.0 109.684 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.735 ' CD2' HD12 ' B' ' 35' ' ' LEU . 3.0 m-85 -58.29 -52.16 66.74 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.207 -0.933 . . . . 0.0 109.056 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' B' ' 26' ' ' LYS . 12.2 m -51.86 -27.06 11.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.439 -0.788 . . . . 0.0 109.551 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . -66.95 -41.51 93.26 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 21' ' ' GLU . 1.3 mmt180 -43.66 -48.51 7.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -1.128 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' B' ' 20' ' ' ARG . 22.0 mt-10 -162.78 148.3 12.15 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.278 -0.889 . . . . 0.0 109.439 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 87.87 75.98 1.28 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' B' ' 22' ' ' GLY . 2.2 m-20 43.74 -148.8 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.177 -1.19 . . . . 0.0 109.523 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -144.5 68.8 1.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.432 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.3 -38.56 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.918 . . . . 0.0 109.471 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -113.15 169.88 8.62 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.917 . . . . 0.0 109.401 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 31' ' ' GLU . 12.8 mt -93.97 138.73 31.76 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -0.96 . . . . 0.0 109.612 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.554 ' O ' ' CG ' ' B' ' 28' ' ' LYS . 0.1 OUTLIER -94.46 82.65 4.05 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.382 -0.824 . . . . 0.0 109.504 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.543 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 6.8 ttmt 44.43 -91.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.113 -0.992 . . . . 0.0 110.196 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 28' ' ' LYS . 45.0 m -43.22 -36.88 1.92 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.872 -1.143 . . . . 0.0 110.071 -179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.5 ' HB3' ' HB3' ' B' ' 27' ' ' LEU . 1.4 mp0 -43.04 -51.43 5.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.084 -1.01 . . . . 0.0 110.352 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.997 HD13 HD22 ' B' ' 60' ' ' LEU . 0.3 OUTLIER -74.63 -35.67 62.9 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.19 -0.944 . . . . 0.0 109.068 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.542 ' HD3' HG11 ' B' ' 53' ' ' VAL . 1.5 ttpt -52.15 -27.67 15.17 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.054 -1.029 . . . . 0.0 108.741 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.512 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.6 OUTLIER -83.32 -52.34 6.64 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.297 -0.877 . . . . 0.0 108.828 179.465 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.882 HD22 ' CE1' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -43.12 -38.96 2.6 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.438 -0.789 . . . . 0.0 108.98 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.863 HG23 HD22 ' B' ' 44' ' ' LEU . 3.8 mt -78.8 -39.1 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 O-C-N 121.561 -0.712 . . . . 0.0 109.318 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -75.94 -0.25 20.81 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.505 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.26 -53.08 3.22 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.161 -0.962 . . . . 0.0 109.069 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.511 ' HG2' HD22 ' A' ' 3' ' ' LEU . 1.0 OUTLIER -105.31 -28.48 10.88 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.325 -0.86 . . . . 0.0 109.001 179.609 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.871 ' HB3' HD13 ' B' ' 44' ' ' LEU . 74.3 mt -98.02 56.32 1.22 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.406 -0.809 . . . . 0.0 109.37 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 11.5 m -113.16 -4.39 13.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.249 -0.907 . . . . 0.0 109.626 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -81.64 -90.77 0.07 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.146 -0.971 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -72.6 -3.82 27.09 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.933 HD23 HD11 ' B' ' 47' ' ' ILE . 0.1 OUTLIER -98.81 64.05 1.44 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.261 -0.9 . . . . 0.0 109.586 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 46' ' ' GLU . 0.0 OUTLIER -101.01 174.52 5.97 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.199 -0.938 . . . . 0.0 109.431 179.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' B' ' 45' ' ' GLU . 1.1 tt0 77.76 -3.45 2.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.345 -0.847 . . . . 0.0 109.755 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.933 HD11 HD23 ' B' ' 44' ' ' LEU . 4.8 mt -71.36 -6.56 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.104 -0.997 . . . . 0.0 109.444 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -76.77 3.28 12.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.132 -0.98 . . . . 0.0 109.52 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.49 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 1.2 mm-40 -123.54 14.66 9.52 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.209 -0.932 . . . . 0.0 108.98 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.524 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 75.04 54.21 0.07 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.397 -0.814 . . . . 0.0 109.546 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.4 ' OE1' ' HB3' ' B' ' 46' ' ' GLU . 0.7 OUTLIER -90.08 -70.8 0.65 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.192 -0.943 . . . . 0.0 109.502 179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.915 HG11 ' HA ' ' B' ' 80' ' ' VAL . 1.4 t -93.87 -24.31 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.108 -0.995 . . . . 0.0 108.753 179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.542 HG11 ' HD3' ' B' ' 33' ' ' LYS . 45.8 t -77.22 -17.23 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.356 -0.84 . . . . 0.0 108.869 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.524 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 41.0 t0 -84.18 -46.71 11.6 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.365 -0.835 . . . . 0.0 109.113 179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -71.45 -49.8 38.0 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.236 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.81 HG11 HG22 ' B' ' 80' ' ' VAL . 21.4 m -54.21 -46.74 68.11 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.319 0 O-C-N 121.134 -0.978 . . . . 0.0 109.352 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.616 ' N ' HG23 ' B' ' 56' ' ' VAL . 7.4 tpt -43.54 -44.55 6.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 109.719 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -54.43 45.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.209 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.579 HG22 ' O ' ' B' ' 56' ' ' VAL . 4.9 t -71.55 -9.09 57.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 109.542 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.997 HD22 HD13 ' B' ' 32' ' ' LEU . 0.3 OUTLIER -90.88 -10.83 41.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.37 -0.831 . . . . 0.0 109.459 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.14 82.43 6.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 109.294 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -85.01 13.17 6.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.722 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -160.76 27.29 0.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.518 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.443 ' O ' ' OD1' ' B' ' 65' ' ' ASP . . . 49.94 68.5 1.37 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' B' ' 64' ' ' GLY . 0.4 OUTLIER -177.06 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.275 -1.133 . . . . 0.0 108.603 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' B' ' 27' ' ' LEU . . . 110.12 8.25 25.8 Favored Glycine 0 N--CA 1.486 1.983 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.466 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 1.4 mt-10 -69.91 85.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -1.136 . . . . 0.0 109.455 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' B' ' 60' ' ' LEU . 4.1 m -69.95 140.79 53.07 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG2' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -100.67 172.71 6.92 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.958 ' CE2' HD13 ' B' ' 11' ' ' ILE . 0.7 OUTLIER -64.97 -58.83 5.1 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.101 -0.999 . . . . 0.0 110.463 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.81 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.2 OUTLIER -50.92 -49.67 59.14 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.166 -0.959 . . . . 0.0 109.272 -179.511 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.642 ' CB ' ' CZ ' ' B' ' 76' ' ' PHE . 1.3 mm-40 -68.06 -24.56 65.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.382 -0.824 . . . . 0.0 109.021 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.882 ' CE1' HD22 ' B' ' 35' ' ' LEU . 1.7 t80 -66.05 -60.75 2.53 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.479 -0.763 . . . . 0.0 109.606 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.82 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 2.6 mtm -53.55 -34.86 59.77 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.068 -1.02 . . . . 0.0 109.159 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.834 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -68.86 -34.25 75.15 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.12 -0.987 . . . . 0.0 108.723 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CZ ' ' CB ' ' B' ' 72' ' ' GLU . 20.4 m-30 -65.31 -66.17 0.58 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.764 HG13 HD11 ' B' ' 40' ' ' LEU . 57.4 t -47.2 -26.72 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 1.045 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -56.95 -64.72 0.78 Allowed 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 6.0 mtm -56.86 -61.91 2.11 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.197 -0.939 . . . . 0.0 109.408 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.915 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.1 OUTLIER -46.35 -22.96 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 O-C-N 120.66 -1.275 . . . . 0.0 109.528 -179.183 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.533 ' CG2' ' CE ' ' A' ' 7' ' ' MET . 30.2 m -79.0 -69.46 0.57 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.929 -1.107 . . . . 0.0 109.055 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.3 t -76.41 -48.89 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.142 -0.974 . . . . 0.0 109.073 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.91 -35.16 0.09 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.749 -0.594 . . . . 0.0 110.022 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.536 ' CB ' ' HG ' ' B' ' 44' ' ' LEU . 2.7 t -89.64 -37.49 14.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -0.964 . . . . 0.0 109.712 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 85' ' ' HIS . 1.3 t60 -64.96 -12.12 46.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.205 -0.935 . . . . 0.0 109.551 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.5 ' CG ' ' O ' ' B' ' 83' ' ' ALA . 5.6 pt-20 -90.15 -33.96 16.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.909 . . . . 0.0 109.6 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.488 ' N ' ' HG3' ' B' ' 86' ' ' GLU . 1.5 t80 -68.3 -19.22 64.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.507 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -10.03 59.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.527 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -106.33 169.6 8.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.934 . . . . 0.0 109.484 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.469 ' N ' ' CD2' ' B' ' 90' ' ' HIS . 0.1 OUTLIER -166.26 40.48 0.05 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 109.495 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 118.039 -0.981 . . . . 0.0 109.492 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 49.7 m . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.516 ' HG3' ' CG2' ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.26 -95.5 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.895 . . . . 0.0 109.66 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.765 HD13 HG21 ' B' ' 13' ' ' VAL . 7.3 mp -47.23 -29.31 2.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.1 -1.0 . . . . 0.0 109.739 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.564 ' OE2' ' CD2' ' B' ' 42' ' ' HIS . 0.5 OUTLIER -52.14 -60.4 3.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.148 -0.97 . . . . 0.0 109.172 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -35.01 79.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.329 -0.857 . . . . 0.0 109.018 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.887 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -69.87 -10.76 59.67 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.345 -0.847 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -89.88 -47.61 7.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.303 -0.873 . . . . 0.0 109.196 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.439 ' O ' HG22 ' A' ' 11' ' ' ILE . 52.4 t -64.68 -27.16 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.304 -0.873 . . . . 0.0 109.233 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.625 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -85.54 -58.29 2.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.341 -0.849 . . . . 0.0 109.366 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.8 mt -49.14 -34.28 13.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.267 -0.896 . . . . 0.0 109.337 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.602 HG23 ' N ' ' A' ' 12' ' ' ASP . 3.3 tt -76.21 -46.06 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 109.53 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' HG23 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -55.12 -21.32 12.57 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.331 -0.855 . . . . 0.0 109.552 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.661 HG22 ' HE2' ' A' ' 17' ' ' TYR . 0.6 OUTLIER -90.13 -39.63 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.141 -0.974 . . . . 0.0 109.674 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CD2' ' CD2' ' A' ' 70' ' ' PHE . 25.3 t80 -53.73 -41.92 67.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.819 -1.175 . . . . 0.0 108.858 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -79.25 -44.43 21.78 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.341 -0.849 . . . . 0.0 109.205 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.435 ' C ' ' O ' ' A' ' 15' ' ' HIS . 1.7 tt0 -44.4 -38.93 4.32 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.268 -0.895 . . . . 0.0 108.82 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.79 ' CE2' HD21 ' A' ' 35' ' ' LEU . 80.8 m-85 -94.08 -78.04 0.44 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.525 ' OG ' ' CA ' ' A' ' 24' ' ' LYS . 24.4 p 39.05 28.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.594 -0.691 . . . . 0.0 110.006 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' TYR . . . 76.9 51.82 6.12 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 17' ' ' TYR . 32.7 mtp180 -40.65 -29.52 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.5 -1.0 . . . . 0.0 109.732 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -98.5 85.89 3.47 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.237 -0.915 . . . . 0.0 109.428 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 23' ' ' ASP . . . 103.69 91.87 2.22 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.447 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 9.8 t70 70.94 154.97 0.14 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.199 -1.177 . . . . 0.0 109.402 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.525 ' CA ' ' OG ' ' A' ' 18' ' ' SER . 10.9 mttp -134.64 60.44 1.7 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.514 ' N ' ' HB2' ' A' ' 18' ' ' SER . 1.6 t-80 -130.42 -35.18 1.54 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.21 -0.931 . . . . 0.0 109.558 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.543 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -140.83 167.43 22.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.4 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD12 ' CD2' ' A' ' 32' ' ' LEU . 9.0 mt -88.92 170.06 11.03 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.138 -0.976 . . . . 0.0 109.719 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 2.6 ptmm? -138.92 71.12 1.38 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.375 -0.828 . . . . 0.0 109.238 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER 64.9 -83.08 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.581 -0.699 . . . . 0.0 110.225 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 91.0 p -41.98 -55.57 3.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.559 ' OE1' ' CD1' ' A' ' 17' ' ' TYR . 2.8 mm-40 -45.92 -45.82 15.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.054 -1.028 . . . . 0.0 108.717 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.81 HD12 ' SD ' ' A' ' 57' ' ' MET . 16.3 mt -52.14 -68.25 0.19 Allowed 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.717 ' HG2' HG11 ' A' ' 53' ' ' VAL . 19.3 mttt -38.27 -31.08 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.558 -0.714 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 31' ' ' GLU . 7.9 mm-40 -67.45 -67.61 0.44 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.085 -1.01 . . . . 0.0 109.169 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.79 HD21 ' CE2' ' A' ' 17' ' ' TYR . 18.6 mt -43.85 -45.69 7.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.337 -0.852 . . . . 0.0 109.461 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.12 HD11 ' CE1' ' A' ' 76' ' ' PHE . 44.7 mm -54.05 -62.0 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.384 -0.822 . . . . 0.0 109.672 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.579 ' HB3' ' CD2' ' A' ' 43' ' ' PHE . 10.8 m120 -83.08 16.7 2.25 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.34 -0.85 . . . . 0.0 110.162 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m120 -142.06 16.94 2.1 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.037 -1.04 . . . . 0.0 109.742 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.952 ' OE2' HG13 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -158.4 -33.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.955 -1.091 . . . . 0.0 110.563 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.849 ' CB ' HD21 ' A' ' 44' ' ' LEU . 2.0 mm? -53.49 -68.94 0.13 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.926 -1.109 . . . . 0.0 109.644 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.499 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER 161.31 -76.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.837 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.576 ' CE1' ' HA ' ' A' ' 44' ' ' LEU . 6.2 p80 -90.89 22.52 3.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.286 -0.884 . . . . 0.0 108.997 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.579 ' CD2' ' HB3' ' A' ' 37' ' ' ASN . 3.6 m-85 62.57 27.21 16.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.473 -0.767 . . . . 0.0 109.811 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.065 HD23 HG22 ' A' ' 36' ' ' ILE . 1.7 mm? 45.41 25.89 0.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.071 -1.018 . . . . 0.0 109.211 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' A' ' 44' ' ' LEU . 2.2 mt-10 70.73 47.89 0.45 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.234 -0.916 . . . . 0.0 109.186 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.468 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.3 OUTLIER 42.74 32.81 0.41 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.359 -0.838 . . . . 0.0 109.427 -179.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 1.048 HD13 HG21 ' A' ' 53' ' ' VAL . 1.2 mt 50.12 98.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.276 -0.89 . . . . 0.0 109.119 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 17.1 ptpt -40.1 -35.44 0.39 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.463 -0.773 . . . . 0.0 109.873 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 11.8 pt-20 178.13 -31.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.855 . . . . 0.0 109.435 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.555 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mt-30 165.17 50.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.328 -0.857 . . . . 0.0 109.147 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -90.32 -70.23 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.895 . . . . 0.0 110.135 -179.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.775 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.7 OUTLIER -86.2 -23.37 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.127 -0.983 . . . . 0.0 109.954 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.048 HG21 HD13 ' A' ' 47' ' ' ILE . 83.7 t -81.69 -32.16 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 120.793 -1.192 . . . . 0.0 109.405 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.555 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -90.58 -28.35 18.52 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.188 -0.945 . . . . 0.0 109.499 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 10.3 tptm -87.34 -42.48 12.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.713 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.891 HG13 HD11 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -73.93 -29.8 26.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.118 -0.989 . . . . 0.0 109.127 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.81 ' SD ' HD12 ' A' ' 32' ' ' LEU . 6.9 tpt -49.42 -39.33 32.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.359 -0.838 . . . . 0.0 109.48 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.33 -48.2 20.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.859 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 3.9 t -66.1 -9.53 31.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.891 HD11 HG13 ' A' ' 56' ' ' VAL . 35.2 mt -82.68 -52.83 6.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.924 . . . . 0.0 109.347 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.62 ' OD2' ' HE2' ' A' ' 57' ' ' MET . 1.0 OUTLIER -75.76 86.9 2.77 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.49 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -90.64 25.72 2.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 109.428 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -121.8 -27.76 4.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.46 94.67 1.02 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.7 -31.8 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.267 -1.137 . . . . 0.0 108.576 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.11 -23.91 19.92 Favored Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.543 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 4.8 mm-40 -83.94 136.7 33.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.22 -1.165 . . . . 0.0 109.409 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.529 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -71.84 170.47 13.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.223 -0.923 . . . . 0.0 109.927 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.4 OUTLIER -136.78 171.4 14.56 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.481 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.5 OUTLIER -61.4 -62.2 1.99 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.799 -1.188 . . . . 0.0 110.354 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.697 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 0.9 OUTLIER -47.79 -28.67 2.66 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.034 -1.041 . . . . 0.0 108.918 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.529 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -73.22 -43.13 61.77 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.548 -0.72 . . . . 0.0 109.64 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.608 ' CZ ' ' CG1' ' A' ' 13' ' ' VAL . 29.2 t80 -56.24 -54.36 46.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.875 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.875 ' CB ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -56.4 -58.19 9.08 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.047 -1.033 . . . . 0.0 109.344 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . . . -57.75 -17.38 15.12 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.2 -0.938 . . . . 0.0 108.975 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 1.12 ' CE1' HD11 ' A' ' 36' ' ' ILE . 1.0 OUTLIER -71.66 -70.43 0.32 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.457 -0.777 . . . . 0.0 109.138 179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.952 HG13 ' OE2' ' A' ' 39' ' ' GLU . 46.5 t -52.23 -29.52 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.427 -0.795 . . . . 0.0 109.188 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.851 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -64.22 -41.95 96.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.28 -0.888 . . . . 0.0 109.709 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.693 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.3 mtm -78.19 -70.42 0.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 109.73 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.898 HG11 HD12 ' A' ' 36' ' ' ILE . 0.1 OUTLIER -43.82 -23.96 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.472 -1.393 . . . . 0.0 109.695 -179.227 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.586 ' N ' HD11 ' A' ' 40' ' ' LEU . 16.8 m -80.34 -68.13 0.71 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.926 -1.109 . . . . 0.0 108.871 178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 2.2 t -77.51 -49.3 15.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.181 -0.949 . . . . 0.0 108.796 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.05 -43.34 0.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.741 -0.599 . . . . 0.0 109.818 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -90.05 -28.76 18.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.314 -0.866 . . . . 0.0 109.607 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 81' ' ' THR . 16.5 t-160 -69.65 -9.69 55.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.907 . . . . 0.0 109.592 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.423 ' HA ' ' CE1' ' A' ' 88' ' ' PHE . 0.9 OUTLIER -88.44 -10.16 50.08 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.203 -0.936 . . . . 0.0 109.497 -179.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.404 ' O ' ' C ' ' A' ' 88' ' ' PHE . 0.4 OUTLIER -62.82 -21.93 66.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 0.0 109.547 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.575 ' CG ' ' N ' ' A' ' 89' ' ' GLU . 19.0 p90 -43.61 -45.95 7.0 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 109.474 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' N ' ' CG ' ' A' ' 88' ' ' PHE . 2.3 tt0 43.63 93.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.266 -0.896 . . . . 0.0 109.628 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -144.41 81.39 1.66 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.44 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.532 179.988 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.462 ' HB3' ' HB2' ' B' ' 4' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.625 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -59.68 -72.53 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.196 -0.94 . . . . 0.0 109.833 -179.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.75 HD22 ' N ' ' B' ' 3' ' ' LEU . 3.6 mm? -73.69 -31.64 63.54 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.111 -0.993 . . . . 0.0 109.89 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.462 ' HB2' ' HB3' ' B' ' 1' ' ' SER . 3.3 tt0 -56.97 -58.92 6.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.212 -0.93 . . . . 0.0 109.389 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -64.36 -31.09 72.16 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.86 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 6' ' ' ALA . . . -75.97 -14.01 60.24 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.336 -0.853 . . . . 0.0 109.507 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.539 ' O ' HD12 ' B' ' 11' ' ' ILE . 2.4 mtp -86.87 -37.75 17.4 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 24.6 t -73.83 -34.64 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -0.907 . . . . 0.0 109.397 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.76 -43.27 37.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.663 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.677 HD13 ' CZ ' ' B' ' 73' ' ' PHE . 3.4 mm? -66.47 -55.46 15.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.539 HD12 ' O ' ' B' ' 7' ' ' MET . 45.0 mt -52.35 -47.8 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -0.858 . . . . 0.0 109.72 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -63.16 -33.74 76.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.607 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.779 ' CG1' HD11 ' B' ' 35' ' ' LEU . 0.9 OUTLIER -73.53 -15.69 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.224 -0.923 . . . . 0.0 109.339 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 13.4 t80 -82.89 -44.98 14.77 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.965 -1.084 . . . . 0.0 108.981 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.456 ' O ' ' OG ' ' B' ' 18' ' ' SER . 75.1 m-70 -66.24 -31.21 71.89 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.411 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.492 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 4.2 tt0 -81.04 -50.46 9.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.158 -0.964 . . . . 0.0 109.407 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.861 ' O ' HD22 ' B' ' 27' ' ' LEU . 10.0 m-85 -78.68 4.03 14.8 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.308 -0.87 . . . . 0.0 109.574 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.554 ' HA ' HD23 ' B' ' 27' ' ' LEU . 2.1 p -83.36 41.45 0.77 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.194 -0.941 . . . . 0.0 109.76 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' B' ' 20' ' ' ARG . . . 103.99 55.67 0.77 Allowed Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' B' ' 16' ' ' GLN . 11.9 mtp85 -45.02 -26.39 0.43 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.31 -1.112 . . . . 0.0 109.132 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -132.06 117.22 18.08 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.327 -0.858 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.04 -109.62 3.76 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -63.62 178.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.26 -1.141 . . . . 0.0 109.421 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' B' ' 18' ' ' SER . 15.4 ttmm -161.51 56.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.517 ' N ' ' HB2' ' B' ' 18' ' ' SER . 0.3 OUTLIER -161.64 -36.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.587 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.482 ' C ' HD23 ' B' ' 27' ' ' LEU . 33.1 mtmt -131.67 170.16 15.16 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.144 -0.972 . . . . 0.0 109.481 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.861 HD22 ' O ' ' B' ' 17' ' ' TYR . 4.0 mt -95.29 142.9 27.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.172 -0.955 . . . . 0.0 109.918 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.523 ' CG ' ' OE2' ' B' ' 31' ' ' GLU . 9.4 pttp -124.32 74.29 1.3 Allowed 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.418 -0.801 . . . . 0.0 108.874 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.678 ' HA ' HD12 ' B' ' 32' ' ' LEU . 4.6 tppt? 68.3 -81.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.692 -0.63 . . . . 0.0 110.283 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -49.47 -46.02 47.52 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.083 -1.011 . . . . 0.0 110.406 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' CG ' ' B' ' 28' ' ' LYS . 0.3 OUTLIER -58.18 -34.64 70.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.0 -1.062 . . . . 0.0 109.618 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.807 HD23 HD12 ' B' ' 27' ' ' LEU . 12.1 mt -67.98 -69.57 0.31 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.478 -0.763 . . . . 0.0 109.51 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.477 ' HG3' HG11 ' B' ' 53' ' ' VAL . 8.8 mtpt -40.76 -27.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.396 -0.815 . . . . 0.0 110.171 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.498 ' OE1' ' CA ' ' B' ' 34' ' ' GLU . 0.5 OUTLIER -76.91 -58.75 3.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.034 -1.041 . . . . 0.0 109.424 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.807 HD21 ' CE1' ' B' ' 73' ' ' PHE . 23.4 tp -41.37 -47.16 3.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.521 -0.737 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.716 HG23 HD12 ' B' ' 40' ' ' LEU . 1.3 mp -78.16 -38.95 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.113 -0.992 . . . . 0.0 110.082 -179.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' B' ' 33' ' ' LYS . 2.1 m-80 -80.29 4.53 17.43 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.927 -1.108 . . . . 0.0 110.044 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.465 ' HB3' ' OH ' ' B' ' 17' ' ' TYR . 1.0 OUTLIER -126.68 -16.08 5.34 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.09 -1.006 . . . . 0.0 109.937 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.549 ' CG ' ' HB2' ' A' ' 3' ' ' LEU . 64.9 mm-40 -123.86 -9.74 7.76 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.109 -0.995 . . . . 0.0 109.633 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.877 ' HB3' HD22 ' B' ' 44' ' ' LEU . 37.0 mt -117.29 67.17 0.74 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.199 -0.938 . . . . 0.0 109.685 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.58 ' O ' ' CG ' ' B' ' 42' ' ' HIS . 0.4 OUTLIER -112.56 46.88 1.14 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.336 -0.852 . . . . 0.0 109.087 179.681 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.58 ' CG ' ' O ' ' B' ' 41' ' ' SER . 93.4 m-70 -160.9 99.71 1.24 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.378 -0.826 . . . . 0.0 108.91 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.531 ' CB ' ' O ' ' B' ' 42' ' ' HIS . 4.0 m-85 81.67 17.3 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.654 -0.654 . . . . 0.0 109.415 -179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.903 HD21 ' O ' ' B' ' 80' ' ' VAL . 0.1 OUTLIER -123.52 -9.5 7.96 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.464 ' O ' ' O ' ' B' ' 44' ' ' LEU . 1.8 mm-40 45.89 -171.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.229 -0.919 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' B' ' 48' ' ' LYS . 4.4 mm-40 -83.01 158.76 22.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.222 -0.924 . . . . 0.0 109.419 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.695 HD12 HG23 ' B' ' 53' ' ' VAL . 24.6 mm -58.53 -24.05 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.172 -0.955 . . . . 0.0 109.431 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.564 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 5.8 mttt 83.09 -42.67 0.1 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.692 -0.63 . . . . 0.0 109.713 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' B' ' 50' ' ' GLN . 0.8 OUTLIER 164.52 -25.26 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.097 -1.002 . . . . 0.0 109.368 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.511 ' HB2' ' HB2' ' B' ' 54' ' ' ASP . 0.0 OUTLIER 165.11 51.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.265 -0.897 . . . . 0.0 109.574 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.478 ' OE1' ' HE3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.14 -70.66 0.66 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.135 -0.978 . . . . 0.0 109.558 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.776 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.4 t -90.85 -24.79 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.231 -0.918 . . . . 0.0 108.982 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.695 HG23 HD12 ' B' ' 47' ' ' ILE . 69.7 t -72.39 -22.22 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.283 -0.885 . . . . 0.0 108.928 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.511 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 7.6 t70 -86.91 -53.47 4.88 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.302 -0.874 . . . . 0.0 109.111 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.47 -42.52 78.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.287 -0.883 . . . . 0.0 109.122 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.905 ' HB ' HD13 ' B' ' 60' ' ' LEU . 35.2 m -61.85 -47.36 93.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 O-C-N 121.235 -0.915 . . . . 0.0 109.196 179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.606 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -43.08 -27.62 0.22 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.4 OUTLIER -77.58 -47.44 19.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.336 -0.853 . . . . 0.0 108.699 179.217 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.454 ' O ' ' C ' ' B' ' 60' ' ' LEU . 9.2 m -76.26 -66.44 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.378 -0.826 . . . . 0.0 109.095 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.905 HD13 ' HB ' ' B' ' 56' ' ' VAL . 1.5 mp -39.9 -30.16 0.08 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.51 -0.744 . . . . 0.0 109.635 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' B' ' 59' ' ' THR . 48.9 t0 -90.21 110.68 21.71 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.232 -0.918 . . . . 0.0 109.425 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -141.98 25.5 1.93 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -0.955 . . . . 0.0 109.531 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -119.62 -15.54 8.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 90.33 55.31 1.97 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 8.0 t70 179.28 -33.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.228 -1.16 . . . . 0.0 108.634 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.428 ' HA2' ' OD2' ' B' ' 61' ' ' ASP . . . 110.1 34.34 2.37 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.476 ' HB3' ' HD2' ' B' ' 26' ' ' LYS . 7.2 mm-40 -104.87 114.44 28.64 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -1.147 . . . . 0.0 109.434 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.555 ' HB2' HD21 ' B' ' 32' ' ' LEU . 12.0 t -70.1 158.31 35.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.278 -0.889 . . . . 0.0 109.617 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.489 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -132.05 171.18 13.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.405 -0.809 . . . . 0.0 108.924 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.471 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -53.2 -48.36 68.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.321 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.435 ' HB3' ' HG2' ' A' ' 79' ' ' MET . 2.0 pt20 -59.27 -36.01 74.75 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.345 -0.847 . . . . 0.0 108.826 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.489 ' HG3' ' HB2' ' B' ' 69' ' ' ASP . 0.6 OUTLIER -82.23 -12.34 58.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.409 -0.807 . . . . 0.0 109.217 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.807 ' CE1' HD21 ' B' ' 35' ' ' LEU . 3.8 t80 -73.11 -57.92 3.68 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.851 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 46.4 mtt -68.31 -44.33 75.66 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.388 -0.82 . . . . 0.0 109.332 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.923 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . . . -59.82 -40.6 89.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -0.876 . . . . 0.0 109.406 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.883 ' CD2' HD21 ' B' ' 60' ' ' LEU . 1.2 t80 -57.43 -68.73 0.21 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.271 -0.893 . . . . 0.0 109.131 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.649 HG13 HD21 ' B' ' 40' ' ' LEU . 71.2 t -52.45 -22.69 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.875 ' HB2' ' CB ' ' A' ' 74' ' ' MET . . . -62.07 -50.87 70.25 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.56 -0.713 . . . . 0.0 109.206 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.697 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 29.7 mtp -74.01 -66.92 0.66 Allowed 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.43 -0.794 . . . . 0.0 109.366 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.903 ' O ' HD21 ' B' ' 44' ' ' LEU . 0.1 OUTLIER -42.59 -25.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.502 -1.374 . . . . 0.0 109.631 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.728 ' HA ' HD11 ' B' ' 44' ' ' LEU . 5.9 m -78.63 -70.01 0.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.982 -1.074 . . . . 0.0 108.722 178.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.562 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 3.1 t -77.82 -49.07 15.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.226 -0.921 . . . . 0.0 108.765 179.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -39.39 -44.09 1.29 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.684 -0.635 . . . . 0.0 109.543 179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' B' ' 44' ' ' LEU . 46.4 t -73.27 -40.37 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.861 . . . . 0.0 109.478 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -64.17 -13.49 48.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.22 -0.925 . . . . 0.0 109.398 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -77.23 -40.57 44.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.46 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -30.79 70.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -53.32 -36.0 60.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -105.76 98.95 8.57 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.205 -0.934 . . . . 0.0 109.492 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -166.8 158.3 12.72 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.251 -0.906 . . . . 0.0 109.451 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.475 -179.965 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.467 ' HG2' ' CB ' ' B' ' 9' ' ' ALA . 41.4 tt0 -80.29 -61.75 1.88 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.257 -0.902 . . . . 0.0 109.446 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.971 HD11 HD13 ' B' ' 10' ' ' LEU . 12.1 tp -64.43 -11.09 29.75 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.269 -0.895 . . . . 0.0 109.473 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -89.16 -53.32 4.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.243 -0.911 . . . . 0.0 109.411 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.86 -27.28 63.1 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.911 . . . . 0.0 109.373 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' B' ' 10' ' ' LEU . . . -70.2 -32.67 70.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.412 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.589 ' HE1' ' HG ' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -71.33 -43.33 67.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.441 ' O ' HG22 ' A' ' 11' ' ' ILE . 9.0 t -71.45 -28.4 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.268 -0.895 . . . . 0.0 109.656 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 10' ' ' LEU . . . -78.39 -68.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.927 . . . . 0.0 109.581 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.846 ' CD2' HD13 ' B' ' 3' ' ' LEU . 81.4 mt -43.71 -48.51 7.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.591 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.86 ' O ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -58.97 -44.45 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.867 . . . . 0.0 109.633 -179.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.54 ' N ' HG23 ' A' ' 11' ' ' ILE . 5.8 t70 -66.65 -19.2 65.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 110.063 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.082 HG11 HD11 ' A' ' 35' ' ' LEU . 2.7 t -88.58 -29.51 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.03 -1.044 . . . . 0.0 109.607 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.477 ' CE1' ' HB2' ' A' ' 73' ' ' PHE . 9.8 t80 -71.33 -46.06 61.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.824 -1.172 . . . . 0.0 109.12 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' ' HG2' ' A' ' 24' ' ' LYS . 16.4 t-80 -77.8 -34.71 51.99 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.538 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -68.94 -63.83 0.98 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.919 . . . . 0.0 109.418 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.843 ' CD1' HG13 ' A' ' 13' ' ' VAL . 36.7 m-85 -53.73 -38.52 64.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.251 -0.905 . . . . 0.0 109.435 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 21' ' ' GLU . 18.7 m -68.39 -30.97 70.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.17 -0.956 . . . . 0.0 109.492 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.462 ' HA2' ' HG3' ' A' ' 24' ' ' LYS . . . -57.22 -19.06 30.6 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 1.6 mmt180 -72.3 -38.06 68.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.248 -1.148 . . . . 0.0 109.444 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.472 ' OE2' ' HB2' ' A' ' 23' ' ' ASP . 0.6 OUTLIER -78.26 164.15 25.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.242 -0.912 . . . . 0.0 109.491 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -50.51 -51.91 30.65 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.472 ' HB2' ' OE2' ' A' ' 21' ' ' GLU . 42.5 m-20 -78.17 -173.35 3.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -1.169 . . . . 0.0 109.489 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HG3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -142.08 56.06 1.47 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 109.449 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.506 ' CG ' ' O ' ' A' ' 25' ' ' HIS . 76.0 t60 -169.99 32.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 109.483 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 68' ' ' CYS . 9.2 ptpt -170.03 170.31 7.61 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.197 -0.94 . . . . 0.0 109.524 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.887 HD22 ' HB3' ' A' ' 31' ' ' GLU . 87.4 mt -134.64 129.96 35.67 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.26 -0.9 . . . . 0.0 109.78 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 1.034 ' O ' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -78.75 166.51 22.39 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.181 -0.95 . . . . 0.0 108.763 179.266 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.478 ' CG ' ' SD ' ' A' ' 57' ' ' MET . 11.3 mttt -42.65 -27.22 0.16 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.201 -0.937 . . . . 0.0 109.672 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.435 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -77.59 -58.38 3.3 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.968 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.887 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.6 mm-40 -46.76 -42.83 17.5 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.087 -1.008 . . . . 0.0 109.296 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.034 HD12 ' O ' ' A' ' 28' ' ' LYS . 1.7 mp -59.03 -65.87 0.6 Allowed 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.558 -0.714 . . . . 0.0 109.204 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.701 ' CG ' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -41.58 -32.09 0.33 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.311 -0.868 . . . . 0.0 109.685 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -67.48 -61.73 1.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.212 -0.93 . . . . 0.0 109.468 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.082 HD11 HG11 ' A' ' 13' ' ' VAL . 2.0 mm? -40.92 -51.35 3.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.912 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.929 HG21 HD11 ' A' ' 47' ' ' ILE . 46.6 mt -62.07 -44.17 98.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.208 -0.933 . . . . 0.0 110.025 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' OD1' HG12 ' A' ' 47' ' ' ILE . 72.7 m-20 -88.13 9.93 21.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.15 -0.969 . . . . 0.0 109.954 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 34' ' ' GLU . 1.7 t-20 -105.62 -26.39 11.87 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.118 -0.989 . . . . 0.0 109.085 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.986 ' OE2' HD13 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -134.88 -35.3 0.87 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.405 -0.809 . . . . 0.0 109.547 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.685 HD12 ' N ' ' A' ' 40' ' ' LEU . 7.8 mp -86.32 15.1 5.62 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.569 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.36 -9.04 29.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.552 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -122.65 -10.34 8.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -91.21 -39.51 12.06 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.263 -0.898 . . . . 0.0 109.489 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.846 HD23 ' O ' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -123.97 32.89 5.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.31 -0.869 . . . . 0.0 109.448 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.427 ' O ' ' C ' ' A' ' 46' ' ' GLU . 1.5 mt-10 43.8 71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.251 -0.906 . . . . 0.0 109.543 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.521 ' O ' HD13 ' A' ' 44' ' ' LEU . 14.3 mm-40 43.74 -151.65 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.295 -0.878 . . . . 0.0 109.571 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.929 HD11 HG21 ' A' ' 36' ' ' ILE . 34.8 mm -121.96 -58.45 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.311 -0.868 . . . . 0.0 109.606 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.505 ' CG ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 43.81 -81.99 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 121.933 0.873 . . . . 0.0 110.478 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.599 ' N ' ' O ' ' A' ' 47' ' ' ILE . 13.4 mm-40 -46.02 -33.55 3.47 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.523 ' HA ' ' CG2' ' A' ' 47' ' ' ILE . 1.3 tt0 76.4 32.88 0.56 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 109.351 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 55' ' ' LYS . 3.3 mm-40 -72.69 -49.49 31.14 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.529 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.814 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.3 OUTLIER -91.52 -18.16 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.197 -0.939 . . . . 0.0 109.37 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.777 ' CG2' HG21 ' A' ' 47' ' ' ILE . 25.1 t -82.0 -37.84 15.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 120.793 -1.192 . . . . 0.0 109.022 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.09 -29.66 17.18 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 120.983 -1.073 . . . . 0.0 109.3 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 25.1 tttm -90.91 -35.51 14.69 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.321 -0.862 . . . . 0.0 110.559 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.716 HG13 ' CD1' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -90.52 -25.64 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 120.846 -1.159 . . . . 0.0 110.361 -178.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.838 ' HA ' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -71.96 -49.62 35.78 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.848 -1.157 . . . . 0.0 109.22 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -35.84 74.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.12 -0.988 . . . . 0.0 108.82 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.678 HG22 ' HA ' ' A' ' 56' ' ' VAL . 5.6 t -90.31 -9.83 46.35 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.443 -0.785 . . . . 0.0 109.422 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.838 HD12 ' HA ' ' A' ' 57' ' ' MET . 0.9 OUTLIER -65.89 -45.96 80.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.368 -0.833 . . . . 0.0 109.448 -179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.429 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 9.0 m-20 -61.34 88.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.42 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -71.63 -10.27 59.52 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.284 -0.885 . . . . 0.0 109.504 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.78 -37.29 10.34 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.516 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 65' ' ' ASP . . . 97.78 93.37 1.93 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 64' ' ' GLY . 39.1 t0 178.61 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.269 -1.136 . . . . 0.0 108.658 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 110.18 19.08 8.24 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 26' ' ' LYS . 53.5 mt-10 -127.15 129.25 47.52 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -1.137 . . . . 0.0 109.47 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 8.6 t -69.74 155.54 40.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.639 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.503 ' OD1' ' N ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -126.17 171.44 10.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -61.47 -50.46 72.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.124 -0.985 . . . . 0.0 110.501 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.474 ' HB3' ' HG2' ' B' ' 79' ' ' MET . 2.8 pt20 -58.4 -40.09 81.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.947 . . . . 0.0 108.836 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.521 ' HG3' HD23 ' A' ' 60' ' ' LEU . 1.1 tt0 -80.6 -12.24 59.54 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.477 ' HB2' ' CE1' ' A' ' 14' ' ' PHE . 19.3 t80 -69.94 -51.99 28.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.197 -0.94 . . . . 0.0 108.503 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.833 ' HB2' ' HB2' ' B' ' 78' ' ' ALA . 26.9 mtt -68.98 -43.47 74.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.957 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -67.33 -20.32 65.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 108.652 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.704 ' HE1' HD11 ' A' ' 36' ' ' ILE . 1.1 t80 -68.13 -57.95 5.24 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.651 HG21 HD12 ' B' ' 3' ' ' LEU . 55.0 t -66.86 -25.87 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 121.334 -0.854 . . . . 0.0 108.758 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' B' ' 74' ' ' MET . . . -68.51 -27.27 65.97 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.429 -0.795 . . . . 0.0 109.065 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.66 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 11.6 mtm -84.2 -70.09 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.311 -0.868 . . . . 0.0 108.971 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.846 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -45.65 -23.02 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 O-C-N 120.302 -1.498 . . . . 0.0 109.892 -179.658 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.564 HG23 ' N ' ' A' ' 82' ' ' THR . 4.0 t -85.25 -52.26 6.03 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.747 -1.221 . . . . 0.0 109.327 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.619 HG21 ' HB3' ' B' ' 70' ' ' PHE . 1.1 t -90.82 -51.31 5.43 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.705 -1.221 . . . . 0.0 107.705 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -37.02 -42.06 0.39 Allowed 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.369 0.604 . . . . 0.0 109.628 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.42 -37.02 23.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.289 -0.882 . . . . 0.0 109.428 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.422 ' N ' ' O ' ' A' ' 82' ' ' THR . 2.8 t-160 -60.19 -16.15 30.46 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 89' ' ' GLU . 79.8 mm-40 -85.89 -38.36 18.14 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.219 -0.926 . . . . 0.0 109.43 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.11 -52.02 67.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.249 -0.907 . . . . 0.0 109.451 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -69.06 -68.85 0.37 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.318 -0.864 . . . . 0.0 109.459 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -73.45 136.64 44.24 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.458 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -132.01 142.92 49.74 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.211 -0.931 . . . . 0.0 109.483 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.429 -179.979 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.504 ' HG3' ' CG2' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -45.52 -71.71 0.07 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.255 -0.903 . . . . 0.0 109.622 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 1.005 ' CD2' HG21 ' A' ' 13' ' ' VAL . 4.0 mm? -57.6 -20.22 31.22 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.278 -0.889 . . . . 0.0 109.816 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.8 OUTLIER -62.58 -62.38 1.78 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.196 -0.94 . . . . 0.0 109.521 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' B' ' 9' ' ' ALA . 0.0 OUTLIER -59.39 -40.38 86.41 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.272 -0.892 . . . . 0.0 109.661 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 10' ' ' LEU . . . -68.45 -20.23 64.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.196 -0.94 . . . . 0.0 109.566 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.647 ' O ' HD12 ' B' ' 11' ' ' ILE . 0.0 OUTLIER -74.98 -59.37 2.77 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.548 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.663 HG12 ' OD2' ' B' ' 12' ' ' ASP . 3.4 t -76.52 -11.39 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.24 -0.913 . . . . 0.0 109.473 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.696 ' O ' HG13 ' B' ' 13' ' ' VAL . . . -81.85 -68.41 0.7 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.265 -0.897 . . . . 0.0 109.533 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.971 HD13 HD11 ' A' ' 3' ' ' LEU . 3.5 mm? -62.23 -30.09 70.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.233 -0.917 . . . . 0.0 109.431 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.647 HD12 ' O ' ' B' ' 7' ' ' MET . 74.2 mt -69.85 -47.55 69.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.903 -1.123 . . . . 0.0 108.785 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.663 ' OD2' HG12 ' B' ' 8' ' ' VAL . 0.5 OUTLIER -53.62 -37.86 63.47 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.94 HG11 HD13 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -72.99 -40.41 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 O-C-N 121.136 -0.978 . . . . 0.0 109.495 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' B' ' 73' ' ' PHE . 5.9 t80 -45.61 -47.21 14.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.836 -1.165 . . . . 0.0 108.224 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -80.3 -26.93 38.62 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.436 -0.79 . . . . 0.0 109.551 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -68.06 -70.15 0.28 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.995 . . . . 0.0 108.915 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 1.0 ' CD2' HD22 ' B' ' 35' ' ' LEU . 40.3 m-85 -49.71 -48.79 49.66 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.333 -0.854 . . . . 0.0 109.319 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 81.2 p -56.33 -35.35 67.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 109.716 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.455 ' HA2' ' HG2' ' B' ' 24' ' ' LYS . . . -66.58 -36.25 91.12 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HG2' ' HA ' ' B' ' 17' ' ' TYR . 2.5 mmt180 -44.01 -28.29 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.276 -1.131 . . . . 0.0 109.513 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.475 ' HB3' ' HE3' ' B' ' 28' ' ' LYS . 5.9 mm-40 -126.64 156.11 41.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.452 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.43 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . -44.03 161.49 0.07 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.441 ' HB2' ' NZ ' ' B' ' 26' ' ' LYS . 25.6 m-20 55.18 100.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.266 -1.138 . . . . 0.0 109.447 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.455 ' HG2' ' HA2' ' B' ' 19' ' ' GLY . 15.0 mtmt -99.34 64.18 1.33 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.472 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.563 ' CD2' ' O ' ' B' ' 25' ' ' HIS . 16.1 t60 -139.86 8.32 2.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.221 -0.925 . . . . 0.0 109.647 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 68' ' ' CYS . 0.0 OUTLIER -170.11 170.19 7.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.173 -0.955 . . . . 0.0 109.591 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' B' ' 31' ' ' GLU . 15.5 mt -107.63 148.84 28.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 21' ' ' GLU . 1.9 ptpt -124.74 85.47 2.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.692 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.501 ' HG2' ' N ' ' B' ' 30' ' ' SER . 24.5 ttmt 59.66 -86.72 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.371 -0.831 . . . . 0.0 110.231 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.501 ' N ' ' HG2' ' B' ' 29' ' ' LYS . 10.1 m -42.97 -56.37 3.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.164 -0.96 . . . . 0.0 110.184 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.3 mp0 -47.49 -42.15 22.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.057 -1.027 . . . . 0.0 109.538 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.641 HD21 ' HB2' ' B' ' 27' ' ' LEU . 26.6 mt -55.39 -61.79 2.11 Favored 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.598 -0.689 . . . . 0.0 109.476 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.756 ' HE2' HG11 ' B' ' 53' ' ' VAL . 6.0 ttmt -47.89 -70.19 0.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.272 -0.893 . . . . 0.0 109.705 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.476 ' OE2' ' HA ' ' B' ' 31' ' ' GLU . 18.8 pt-20 -44.07 -28.76 0.52 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.16 -0.962 . . . . 0.0 109.463 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 1.0 HD22 ' CD2' ' B' ' 17' ' ' TYR . 0.1 OUTLIER -58.75 -57.74 11.66 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.344 -0.848 . . . . 0.0 109.479 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.888 HG23 HD22 ' B' ' 40' ' ' LEU . 2.6 mp -74.07 -55.11 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.287 -0.883 . . . . 0.0 109.687 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.422 ' C ' ' O ' ' B' ' 36' ' ' ILE . 4.9 m120 -41.75 -27.6 0.12 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.308 -0.87 . . . . 0.0 109.771 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.524 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 3.1 m-20 -90.79 -45.65 8.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.189 -0.944 . . . . 0.0 109.549 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.525 ' OE2' ' CG1' ' B' ' 77' ' ' VAL . 0.0 OUTLIER -73.25 -65.65 0.78 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.165 -0.959 . . . . 0.0 109.511 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.888 HD22 HG23 ' B' ' 36' ' ' ILE . 8.5 mp -62.88 -49.71 73.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.257 -0.902 . . . . 0.0 109.48 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.515 ' O ' ' CB ' ' B' ' 42' ' ' HIS . 0.1 OUTLIER 57.2 70.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.203 -0.936 . . . . 0.0 109.376 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.515 ' CB ' ' O ' ' B' ' 41' ' ' SER . 0.7 OUTLIER 76.47 -0.97 2.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.322 -0.861 . . . . 0.0 109.593 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.488 ' HB2' ' CA ' ' B' ' 40' ' ' LEU . 0.1 OUTLIER -65.77 -12.45 54.11 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 109.427 179.928 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.885 HD23 ' H ' ' B' ' 44' ' ' LEU . 2.6 pt? -134.88 28.75 3.51 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.265 -0.897 . . . . 0.0 109.401 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.428 ' O ' ' C ' ' B' ' 46' ' ' GLU . 6.6 tt0 58.38 40.42 24.31 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.334 -0.854 . . . . 0.0 109.511 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.735 ' C ' HD13 ' B' ' 47' ' ' ILE . 0.5 OUTLIER 44.07 -153.02 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.235 -0.916 . . . . 0.0 109.373 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.753 HG21 ' HB ' ' B' ' 53' ' ' VAL . 0.6 OUTLIER -117.84 99.25 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.26 -0.9 . . . . 0.0 109.181 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' B' ' 49' ' ' GLU . 2.8 ptpt -43.41 -26.89 0.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.336 -0.853 . . . . 0.0 109.528 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.517 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.1 tt0 178.36 -32.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.239 -0.913 . . . . 0.0 109.449 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.53 ' CB ' ' HB2' ' B' ' 54' ' ' ASP . 1.2 mt-30 165.09 56.61 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.287 -0.883 . . . . 0.0 109.451 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -70.28 0.68 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.18 -0.95 . . . . 0.0 109.464 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.905 HG11 ' HA ' ' B' ' 80' ' ' VAL . 2.4 t -90.18 -24.37 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.206 -0.934 . . . . 0.0 109.238 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.756 HG11 ' HE2' ' B' ' 33' ' ' LYS . 40.0 t -75.97 -29.86 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.219 -0.926 . . . . 0.0 108.885 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.53 ' HB2' ' CB ' ' B' ' 50' ' ' GLN . 6.8 t0 -79.82 -39.67 30.22 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.326 -0.859 . . . . 0.0 108.895 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.543 ' O ' HG23 ' B' ' 59' ' ' THR . 44.3 mmtt -65.54 -51.93 56.27 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 109.029 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.88 HG22 ' O ' ' B' ' 52' ' ' VAL . 16.5 m -55.8 -45.93 79.73 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 O-C-N 121.287 -0.883 . . . . 0.0 109.641 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.644 ' HE1' ' HA2' ' B' ' 66' ' ' GLY . 0.0 OUTLIER -39.01 -31.66 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.809 -1.182 . . . . 0.0 110.224 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.465 ' O ' ' OD1' ' B' ' 61' ' ' ASP . 0.1 OUTLIER -90.63 -35.98 14.66 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.142 -0.974 . . . . 0.0 109.361 179.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.568 ' OG1' HD23 ' B' ' 60' ' ' LEU . 0.8 OUTLIER -73.15 -60.33 2.29 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.387 -0.82 . . . . 0.0 110.031 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.627 ' CD1' ' CG ' ' B' ' 76' ' ' PHE . 2.9 mt -45.33 -44.21 11.45 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.222 -0.923 . . . . 0.0 109.61 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 58' ' ' GLU . 19.9 p-10 -89.95 111.53 22.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 109.494 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -98.34 -23.13 15.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.569 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -82.26 -20.01 38.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.552 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.26 94.21 0.61 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 173.11 -30.62 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.259 -1.142 . . . . 0.0 108.599 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.644 ' HA2' ' HE1' ' B' ' 57' ' ' MET . . . 110.29 21.14 7.08 Favored Glycine 0 N--CA 1.485 1.926 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -107.74 99.72 9.17 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.246 -1.149 . . . . 0.0 109.409 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.516 ' O ' ' CB ' ' B' ' 26' ' ' LYS . 17.2 t -72.43 157.4 37.7 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.191 -0.943 . . . . 0.0 109.698 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.48 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 1.1 m-20 -117.17 171.58 7.85 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.619 ' HB3' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -59.05 -50.2 74.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.305 -179.715 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.446 ' CG ' ' HG2' ' A' ' 79' ' ' MET . 18.4 mt-30 -55.81 -45.53 78.28 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.27 -0.894 . . . . 0.0 108.944 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.484 ' HB3' ' HA ' ' B' ' 60' ' ' LEU . 1.1 mt-10 -76.82 -13.29 60.02 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.408 -0.807 . . . . 0.0 109.395 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.648 ' HE1' HD21 ' B' ' 35' ' ' LEU . 6.5 t80 -70.72 -66.88 0.55 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.191 -0.943 . . . . 0.0 108.607 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.893 ' HB2' ' HB2' ' A' ' 78' ' ' ALA . 4.1 mtt -58.59 -39.03 79.24 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.341 -0.849 . . . . 0.0 108.884 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.957 ' CB ' ' HB2' ' A' ' 75' ' ' ALA . . . -64.64 -29.8 70.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.294 -0.879 . . . . 0.0 109.059 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.799 ' CE1' HG11 ' B' ' 56' ' ' VAL . 2.0 t80 -64.45 -63.7 1.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.422 -0.798 . . . . 0.0 109.287 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.726 ' CG2' HD12 ' B' ' 35' ' ' LEU . 49.5 t -56.9 -25.71 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.334 -0.854 . . . . 0.0 109.111 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.833 ' HB2' ' HB2' ' A' ' 74' ' ' MET . . . -66.11 -41.81 90.06 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.325 -0.859 . . . . 0.0 109.415 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.0 mtm -73.79 -67.1 0.63 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.261 -0.899 . . . . 0.0 109.41 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.905 ' HA ' HG11 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.46 -25.04 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 120.637 -1.289 . . . . 0.0 109.247 -179.576 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.567 HG23 ' CE ' ' A' ' 7' ' ' MET . 13.0 m -76.3 -70.05 0.47 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.154 -0.966 . . . . 0.0 108.963 178.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.571 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 2.6 t -77.13 -49.53 15.03 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.171 -0.956 . . . . 0.0 108.922 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.71 -31.05 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.757 -0.589 . . . . 0.0 109.774 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.477 ' N ' ' O ' ' B' ' 82' ' ' THR . 47.6 t -87.47 -42.25 12.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.317 -0.864 . . . . 0.0 109.535 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' B' ' 82' ' ' THR . 0.2 OUTLIER -65.69 -9.96 32.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 109.536 -179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.423 ' OE1' ' O ' ' B' ' 91' ' ' GLU . 0.4 OUTLIER -66.18 -17.65 64.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.191 -0.943 . . . . 0.0 109.506 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -73.85 -37.09 64.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -57.59 -69.91 0.15 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.261 -0.9 . . . . 0.0 109.511 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -106.42 149.33 27.14 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.302 -0.874 . . . . 0.0 109.496 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 61.56 174.75 0.12 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.483 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.423 ' O ' ' OE1' ' B' ' 86' ' ' GLU . 1.2 tp10 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.477 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.537 ' HB3' ' CB ' ' A' ' 4' ' ' GLU . 1.3 m . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.635 ' CG ' HG23 ' B' ' 13' ' ' VAL . 0.5 OUTLIER -73.9 -38.89 64.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -0.934 . . . . 0.0 109.306 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.077 HD12 HG21 ' B' ' 77' ' ' VAL . 2.9 mm? -80.33 -34.39 36.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.26 -0.9 . . . . 0.0 109.43 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' A' ' 1' ' ' SER . 25.9 tt0 -60.13 -58.34 8.96 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -63.11 -38.78 92.53 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.22 -0.925 . . . . 0.0 109.254 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.649 ' HB1' HD11 ' B' ' 10' ' ' LEU . . . -73.22 -11.87 60.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.254 -0.904 . . . . 0.0 109.399 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -42.84 16.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.241 -0.912 . . . . 0.0 109.32 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.41 ' C ' HG22 ' A' ' 11' ' ' ILE . 22.0 t -75.53 -25.87 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.405 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.98 -50.01 9.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.224 -0.923 . . . . 0.0 109.514 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.548 HD12 ' CE2' ' A' ' 73' ' ' PHE . 3.9 mm? -62.52 -33.23 74.48 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.586 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -73.25 -46.33 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.218 -0.926 . . . . 0.0 109.468 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.586 ' N ' HG23 ' A' ' 11' ' ' ILE . 9.5 t70 -65.83 -16.94 64.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.292 -0.88 . . . . 0.0 109.414 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.951 HG21 HD13 ' B' ' 3' ' ' LEU . 2.8 t -89.99 -37.3 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.178 -0.952 . . . . 0.0 109.359 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 68.7 t80 -62.83 -43.73 98.02 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.02 -1.05 . . . . 0.0 109.456 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 47.8 m170 -82.19 -49.93 9.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.303 -0.873 . . . . 0.0 109.795 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.53 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 6.2 tt0 -52.1 -59.75 4.0 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 109.612 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.719 ' CG ' HD21 ' A' ' 35' ' ' LEU . 44.7 m-85 -60.57 -48.71 80.59 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.897 . . . . 0.0 109.675 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.467 ' HB2' ' N ' ' A' ' 26' ' ' LYS . 60.1 p -63.04 -11.61 20.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.208 -0.932 . . . . 0.0 109.689 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.521 ' HA2' ' CA ' ' A' ' 24' ' ' LYS . . . -70.69 -37.57 67.23 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 9.9 mmt180 -44.13 -41.63 5.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 8.5 tt0 -76.46 82.91 3.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.924 . . . . 0.0 109.447 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 51.13 -91.15 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 21' ' ' GLU . 12.6 p30 -96.59 158.14 15.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 109.472 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' CA ' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -89.63 119.91 30.46 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.31 -0.869 . . . . 0.0 109.449 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -169.58 -49.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -0.947 . . . . 0.0 109.693 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.516 ' HB3' ' N ' ' A' ' 68' ' ' CYS . 3.6 mtmt -136.48 170.12 16.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 109.71 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD22 ' HB3' ' A' ' 31' ' ' GLU . 24.2 mt -102.43 150.36 23.44 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.292 -0.88 . . . . 0.0 109.463 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.523 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -115.56 70.05 0.74 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.171 -0.956 . . . . 0.0 109.854 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 63.34 -82.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.552 -0.717 . . . . 0.0 110.792 179.215 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.46 ' N ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 t -48.99 -29.09 4.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.034 -1.041 . . . . 0.0 110.32 -179.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.64 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.8 mp0 -66.84 -41.89 86.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.95 -1.094 . . . . 0.0 108.794 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.513 ' CD1' ' HE2' ' A' ' 57' ' ' MET . 14.8 mt -59.71 -61.22 2.78 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.78 ' CE ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -40.49 -45.06 2.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.645 -0.66 . . . . 0.0 109.437 179.627 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.414 ' OE1' ' CA ' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -53.09 -61.32 2.38 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.295 -0.878 . . . . 0.0 109.319 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.719 HD21 ' CG ' ' A' ' 17' ' ' TYR . 3.2 mm? -54.81 -25.6 29.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.266 -0.896 . . . . 0.0 109.929 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.04 HG21 ' CG2' ' A' ' 53' ' ' VAL . 26.6 mm -64.09 -44.79 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.049 -1.032 . . . . 0.0 109.906 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.515 ' ND2' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -82.42 -52.73 6.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.114 -0.991 . . . . 0.0 109.931 -179.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.425 ' C ' ' O ' ' A' ' 37' ' ' ASN . 0.8 OUTLIER -40.52 -52.27 2.83 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.39 -0.818 . . . . 0.0 110.248 -179.584 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.909 ' OE2' HG22 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -96.28 -26.12 15.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.058 -1.026 . . . . 0.0 109.949 -179.506 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.798 HD21 ' SD ' ' B' ' 7' ' ' MET . 5.7 mt -135.51 67.46 1.48 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.471 ' HB2' ' CA ' ' A' ' 37' ' ' ASN . 11.4 t -100.93 -18.63 16.25 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.863 . . . . 0.0 109.455 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -112.56 -41.42 3.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.251 -0.906 . . . . 0.0 109.45 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.468 ' C ' HD23 ' A' ' 44' ' ' LEU . 87.8 m-85 -58.69 -27.26 64.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 0.0 109.428 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 40' ' ' LEU . 1.9 mt -94.16 -16.03 24.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 67.69 65.32 0.39 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.523 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 2.2 tp10 64.9 23.42 12.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.285 -0.884 . . . . 0.0 109.405 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.919 HD13 HG21 ' A' ' 53' ' ' VAL . 6.7 mt 79.81 -9.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.559 -0.713 . . . . 0.0 110.072 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 47' ' ' ILE . 0.6 OUTLIER 83.49 -43.5 0.1 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.509 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.5 mt-10 168.95 36.61 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.135 -0.978 . . . . 0.0 109.311 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 57.85 36.15 26.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 109.34 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 55' ' ' LYS . 0.4 OUTLIER -90.15 -37.38 14.23 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.262 -0.899 . . . . 0.0 109.756 -179.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.897 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.9 t -98.06 -28.42 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.108 -0.995 . . . . 0.0 109.83 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.04 ' CG2' HG21 ' A' ' 36' ' ' ILE . 25.3 t -73.15 -37.35 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.03 -1.044 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -22.32 21.64 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.143 -0.973 . . . . 0.0 109.281 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 51' ' ' GLU . 23.8 tttt -84.1 -25.02 30.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.251 -0.906 . . . . 0.0 109.369 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.901 ' CB ' HD21 ' A' ' 60' ' ' LEU . 2.2 m -59.54 -48.26 87.96 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 O-C-N 121.235 -0.916 . . . . 0.0 109.852 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 15.0 tpp -45.34 -24.62 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.738 -1.226 . . . . 0.0 109.596 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 56' ' ' VAL . 5.7 mm-40 -88.81 -42.14 12.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 109.304 179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.1 m -72.44 -62.39 1.46 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.926 . . . . 0.0 109.307 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.901 HD21 ' CB ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.23 44.04 1.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 109.493 179.785 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 57' ' ' MET . 15.8 p-10 -77.9 109.98 12.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 109.337 179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.523 ' CB ' ' O ' ' A' ' 67' ' ' GLU . 36.8 t30 -49.46 -52.38 29.48 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.163 -0.961 . . . . 0.0 109.44 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -165.49 22.97 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.262 -0.899 . . . . 0.0 109.997 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.44 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 69.78 94.61 0.06 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.44 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.2 OUTLIER 170.13 -29.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.327 -1.102 . . . . 0.0 108.366 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' LYS . . . 110.21 17.11 9.7 Favored Glycine 0 N--CA 1.485 1.913 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.523 ' O ' ' CB ' ' A' ' 62' ' ' ASN . 2.7 pt-20 -113.09 91.2 3.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.27 -1.135 . . . . 0.0 109.109 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.542 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.44 130.89 43.78 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.681 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 2.5 m-20 -101.56 170.55 8.12 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.409 -0.807 . . . . 0.0 108.876 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.411 ' N ' ' CZ ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -51.95 -48.69 64.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.033 -1.042 . . . . 0.0 110.457 -179.702 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.51 ' O ' ' CE ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.28 -41.09 65.21 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 109.416 -179.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.587 ' OE1' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -74.53 -23.1 58.76 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 120.929 -1.107 . . . . 0.0 109.062 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.58 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 18.3 t80 -64.07 -52.73 57.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.197 -0.939 . . . . 0.0 108.534 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.872 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -60.37 -37.85 82.03 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.19 -0.944 . . . . 0.0 108.995 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.529 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -72.73 -19.19 61.43 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.98 . . . . 0.0 108.939 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.882 ' HB2' HD13 ' A' ' 60' ' ' LEU . 9.8 t80 -71.84 -68.31 0.47 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.493 -0.754 . . . . 0.0 109.27 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.909 HG22 ' OE2' ' A' ' 39' ' ' GLU . 39.3 t -66.42 -31.15 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.295 -0.878 . . . . 0.0 109.452 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 74' ' ' MET . . . -59.63 -40.66 88.36 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.282 -0.886 . . . . 0.0 109.384 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.728 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 2.1 mmt -77.76 -71.18 0.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.187 -0.945 . . . . 0.0 109.693 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 1.01 HG11 HD12 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.04 -24.39 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 120.296 -1.502 . . . . 0.0 109.736 -179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.509 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 13.1 m -77.09 -68.81 0.57 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.029 -1.044 . . . . 0.0 108.665 178.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.577 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.34 -49.74 11.11 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.728 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.19 -40.03 0.47 Allowed 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 121.334 0.588 . . . . 0.0 109.589 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.04 -32.88 16.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.263 -0.898 . . . . 0.0 109.477 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -66.34 -9.95 38.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.889 . . . . 0.0 109.534 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -76.38 -43.43 40.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.483 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.51 -31.25 1.05 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.8 -43.84 21.71 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.902 . . . . 0.0 109.522 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 65.94 23.47 11.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.444 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.43 89.62 2.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.903 . . . . 0.0 109.465 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.454 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.542 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.289 0.566 . . . . 0.0 109.481 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -58.03 -75.74 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 109.66 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.951 HD13 HG21 ' A' ' 13' ' ' VAL . 5.9 mp -76.82 -29.68 56.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.606 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.542 ' HB3' ' CB ' ' B' ' 1' ' ' SER . 41.8 tt0 -58.03 -57.69 11.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.139 -0.976 . . . . 0.0 109.146 179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' B' ' 1' ' ' SER . 0.1 OUTLIER -61.27 -47.04 87.83 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.323 -0.861 . . . . 0.0 109.166 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.56 ' HB1' ' CB ' ' A' ' 6' ' ' ALA . . . -65.36 -12.68 54.42 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.288 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.876 ' O ' HD12 ' B' ' 11' ' ' ILE . 8.6 ttt -80.81 -44.45 18.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.362 -0.836 . . . . 0.0 109.296 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 20.3 t -66.38 -44.81 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.898 . . . . 0.0 109.315 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -67.84 -55.85 11.37 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.291 -0.88 . . . . 0.0 109.306 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.745 HD23 HD13 ' A' ' 3' ' ' LEU . 20.9 mt -45.37 -49.8 12.75 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.249 -0.907 . . . . 0.0 109.237 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.876 HD12 ' O ' ' B' ' 7' ' ' MET . 9.3 mt -60.17 -38.64 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.302 -0.874 . . . . 0.0 109.365 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' CB ' ' OE1' ' A' ' 2' ' ' GLU . 0.5 OUTLIER -57.58 -28.64 63.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 -179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.829 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -82.92 -30.82 8.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.208 -0.933 . . . . 0.0 109.268 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.486 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 22.1 t80 -60.79 -51.1 70.75 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.84 -1.162 . . . . 0.0 109.211 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.458 ' HA ' ' OG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -80.16 -37.64 33.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.892 . . . . 0.0 109.615 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.518 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 5.2 tt0 -55.67 -65.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.211 -0.931 . . . . 0.0 109.487 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.581 ' CD2' ' HG ' ' B' ' 35' ' ' LEU . 28.8 m-85 -59.48 -49.73 76.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.552 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.534 ' HB2' ' N ' ' B' ' 26' ' ' LYS . 53.2 p -57.95 -17.27 15.98 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.583 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.94 -37.22 16.53 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.518 ' CZ ' ' OE1' ' B' ' 34' ' ' GLU . 56.4 mtp85 -46.22 -44.16 15.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -1.137 . . . . 0.0 109.465 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.58 169.97 17.28 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.432 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -48.37 -54.37 13.16 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.444 ' O ' ' O ' ' B' ' 18' ' ' SER . 73.2 m-20 -70.15 170.96 10.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -1.118 . . . . 0.0 109.494 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 18' ' ' SER . 1.0 OUTLIER -141.22 70.52 1.35 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.863 . . . . 0.0 109.466 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.486 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 1.0 OUTLIER -170.01 -36.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.362 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.536 ' HB3' ' N ' ' B' ' 68' ' ' CYS . 0.4 OUTLIER -121.89 170.19 10.04 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.919 . . . . 0.0 109.382 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.783 HD23 ' C ' ' B' ' 31' ' ' GLU . 3.6 mp -102.21 144.92 30.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.952 . . . . 0.0 109.705 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -97.73 82.11 3.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' CG ' ' B' ' 57' ' ' MET . 0.0 OUTLIER 41.42 -83.87 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.591 -0.693 . . . . 0.0 110.955 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.604 ' N ' ' O ' ' B' ' 28' ' ' LYS . 4.7 t -48.5 -27.38 2.67 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.788 -1.195 . . . . 0.0 109.959 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.783 ' C ' HD23 ' B' ' 27' ' ' LEU . 2.8 mp0 -59.48 -47.01 87.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.894 -1.129 . . . . 0.0 108.38 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.655 HD21 ' CD ' ' B' ' 72' ' ' GLU . 4.1 mt -59.11 -42.99 91.85 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.965 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -45.64 -67.73 0.26 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.517 -0.739 . . . . 0.0 109.722 179.715 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.54 ' CG ' ' O ' ' B' ' 31' ' ' GLU . 12.7 pt-20 -45.49 -44.28 12.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.151 -0.968 . . . . 0.0 109.786 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.829 HD21 ' CG1' ' B' ' 13' ' ' VAL . 3.2 mt -52.28 -45.73 65.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.1 -1.0 . . . . 0.0 109.617 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 1.019 HG23 HD12 ' B' ' 40' ' ' LEU . 11.9 mt -73.14 -23.84 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.258 -0.901 . . . . 0.0 109.853 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.541 ' ND2' ' N ' ' B' ' 37' ' ' ASN . 0.4 OUTLIER -95.18 -1.06 52.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.165 -0.959 . . . . 0.0 109.679 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -109.89 -20.06 12.89 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.159 -0.963 . . . . 0.0 109.285 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.697 ' C ' HD23 ' B' ' 40' ' ' LEU . 10.9 mm-40 -121.44 -22.14 6.05 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.316 -0.865 . . . . 0.0 109.612 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 1.019 HD12 HG23 ' B' ' 36' ' ' ILE . 4.5 mt -110.5 59.5 0.61 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.219 -0.926 . . . . 0.0 109.535 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 88.4 p -123.88 1.23 8.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.29 -0.881 . . . . 0.0 109.555 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -111.22 -66.66 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.194 -0.941 . . . . 0.0 109.391 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -78.53 -36.6 44.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 109.394 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' B' ' 40' ' ' LEU . 3.2 mp -80.3 -173.36 3.99 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.242 -0.911 . . . . 0.0 109.46 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' B' ' 46' ' ' GLU . 6.0 mt-10 -120.85 44.62 2.45 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.236 -0.915 . . . . 0.0 109.393 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' B' ' 45' ' ' GLU . 4.2 mt-10 44.41 -167.89 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.366 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.824 HD12 HG23 ' B' ' 53' ' ' VAL . 2.3 mm -100.55 81.01 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.42 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER -43.34 -38.92 2.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.5 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -163.92 70.15 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.267 -0.896 . . . . 0.0 109.211 179.913 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.538 ' N ' HG22 ' B' ' 47' ' ' ILE . 16.5 pt20 41.91 37.48 0.81 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.435 -0.791 . . . . 0.0 109.546 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -65.23 -70.3 0.24 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 109.584 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.778 ' O ' HG22 ' B' ' 56' ' ' VAL . 2.1 t -86.04 -13.24 10.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.125 -0.985 . . . . 0.0 109.439 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.965 HG11 ' CG ' ' B' ' 33' ' ' LYS . 69.0 t -81.03 -29.36 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.0 109.014 179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.471 ' HB3' ' O ' ' B' ' 50' ' ' GLN . 33.6 t70 -87.5 -26.1 23.36 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.203 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.2 -40.43 18.13 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.271 -0.893 . . . . 0.0 109.454 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.778 HG22 ' O ' ' B' ' 52' ' ' VAL . 21.0 m -59.83 -45.69 94.56 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 O-C-N 121.205 -0.934 . . . . 0.0 109.606 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -43.06 -27.36 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.969 -1.082 . . . . 0.0 109.258 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.438 ' N ' ' O ' ' B' ' 56' ' ' VAL . 4.1 mt-10 -83.25 -43.33 16.18 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.302 -0.874 . . . . 0.0 108.793 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.893 HG21 ' SD ' ' B' ' 79' ' ' MET . 38.1 m -75.46 -65.82 0.85 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.694 HD13 ' HB2' ' B' ' 76' ' ' PHE . 5.9 mt -41.03 -55.61 2.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.467 -0.771 . . . . 0.0 109.221 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.05 109.56 20.6 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.263 -0.898 . . . . 0.0 109.521 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -111.74 3.33 17.69 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' B' ' 64' ' ' GLY . 3.8 p30 -98.28 -45.83 6.03 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.516 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' B' ' 65' ' ' ASP . . . 102.06 95.13 2.26 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' B' ' 64' ' ' GLY . 57.5 t0 177.5 -32.86 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -1.134 . . . . 0.0 108.583 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.25 -21.62 24.1 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.48 ' HB3' ' HE3' ' B' ' 26' ' ' LYS . 26.0 mt-10 -75.82 106.71 7.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -1.134 . . . . 0.0 109.406 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.584 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -69.68 124.03 22.9 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.237 -0.914 . . . . 0.0 109.437 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.4 OUTLIER -92.14 171.0 9.38 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.389 -0.82 . . . . 0.0 109.112 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.411 ' CE2' ' CD2' ' B' ' 14' ' ' PHE . 0.2 OUTLIER -54.43 -50.62 67.22 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.929 -1.107 . . . . 0.0 109.871 -179.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.455 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -49.21 -29.96 6.36 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.328 -0.857 . . . . 0.0 109.635 -179.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.655 ' CD ' HD21 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -79.13 -34.05 43.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.124 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.989 ' CZ ' HD11 ' A' ' 3' ' ' LEU . 26.8 t80 -61.2 -55.88 27.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.059 -1.026 . . . . 0.0 108.993 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.505 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -62.39 -39.06 92.01 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.385 -0.822 . . . . 0.0 108.818 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.663 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -67.75 -18.9 65.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.333 -0.854 . . . . 0.0 108.819 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.853 ' CE2' HG23 ' B' ' 77' ' ' VAL . 0.0 OUTLIER -71.72 -67.46 0.53 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.415 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 1.077 HG21 HD12 ' A' ' 3' ' ' LEU . 41.4 t -56.94 -31.77 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.493 -0.754 . . . . 0.0 109.608 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.872 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -66.55 -38.86 88.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.894 . . . . 0.0 110.147 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.893 ' SD ' HG21 ' B' ' 59' ' ' THR . 9.4 mtp -78.35 -71.52 0.42 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.007 -1.058 . . . . 0.0 109.527 -179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.655 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -43.36 -25.09 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.848 0 O-C-N 120.445 -1.409 . . . . 0.0 109.654 -179.562 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.481 ' N ' ' O ' ' B' ' 79' ' ' MET . 8.8 m -78.1 -68.79 0.6 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.963 -1.086 . . . . 0.0 108.612 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.574 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.6 t -79.32 -49.96 11.62 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.0 108.628 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.62 -41.2 0.67 Allowed 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 121.334 0.588 . . . . 0.0 109.602 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 1.7 t -89.3 -33.48 16.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.314 -0.866 . . . . 0.0 109.551 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' B' ' 81' ' ' THR . 3.2 t-160 -61.28 -15.41 34.92 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.431 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.3 -40.84 64.2 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.242 -0.911 . . . . 0.0 109.469 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -55.22 -39.63 69.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.488 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -50.76 -49.41 58.16 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.246 -0.909 . . . . 0.0 109.434 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -63.97 151.49 42.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.445 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -110.01 109.18 19.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.237 -0.914 . . . . 0.0 109.496 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.473 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 4' ' ' GLU . 57.6 m . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.642 ' CA ' ' HB1' ' B' ' 9' ' ' ALA . 0.1 OUTLIER -58.92 -71.13 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 109.824 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.065 HD21 HG21 ' B' ' 13' ' ' VAL . 3.2 mm? -73.23 -35.29 66.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.112 -0.992 . . . . 0.0 109.836 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 1' ' ' SER . 19.6 tp10 -55.71 -63.16 1.26 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 109.505 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.4 OUTLIER -61.51 -47.24 86.49 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.284 -0.885 . . . . 0.0 109.406 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' B' ' 6' ' ' ALA . . . -64.49 -11.15 30.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.277 -0.889 . . . . 0.0 109.452 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 4' ' ' GLU . 60.5 ttp -85.4 -41.24 15.61 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.301 -0.874 . . . . 0.0 109.465 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 11' ' ' ILE . 85.5 t -70.79 -29.79 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.988 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -78.93 -54.72 5.76 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.715 HD23 ' CE2' ' A' ' 73' ' ' PHE . 0.1 OUTLIER -55.92 -46.16 78.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.532 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.596 HG23 ' N ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -59.2 -46.17 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.183 -0.948 . . . . 0.0 109.308 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.596 ' N ' HG23 ' A' ' 11' ' ' ILE . 2.7 t0 -59.01 -22.94 61.47 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.174 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 35' ' ' LEU . 2.3 t -82.79 -27.4 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.189 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 22.4 t80 -69.9 -46.64 64.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.973 -1.079 . . . . 0.0 109.45 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -34.79 49.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 109.649 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -67.87 -63.32 1.08 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.248 -0.907 . . . . 0.0 109.597 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.598 ' CD1' HG13 ' A' ' 13' ' ' VAL . 37.5 m-85 -59.14 -51.92 67.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.305 -0.872 . . . . 0.0 109.623 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.48 ' CB ' ' O ' ' A' ' 14' ' ' PHE . 13.9 m -62.41 -12.7 23.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.215 -0.928 . . . . 0.0 109.505 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.489 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . -82.83 10.67 56.43 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.778 -1.329 . . . . 0.0 109.778 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.61 -39.4 17.37 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.211 -1.17 . . . . 0.0 109.465 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.499 ' HG3' ' CD ' ' A' ' 28' ' ' LYS . 2.6 tt0 -84.15 82.1 8.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 109.467 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.49 -132.93 12.1 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.475 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 1.7 m-20 -64.03 -91.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -1.142 . . . . 0.0 109.484 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.489 ' HB3' ' HA2' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 176.54 132.33 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.379 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.428 ' C ' ' HG3' ' A' ' 26' ' ' LYS . 15.3 p-80 -170.03 -53.3 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.149 -0.969 . . . . 0.0 109.835 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.541 ' CE ' ' HB3' ' A' ' 67' ' ' GLU . 50.4 mtmt -148.74 170.19 18.76 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.128 -0.982 . . . . 0.0 109.843 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.846 HD23 ' C ' ' A' ' 31' ' ' GLU . 5.2 mp -94.35 152.16 18.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.282 -0.887 . . . . 0.0 109.806 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' CD ' ' HG3' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -116.65 69.25 0.75 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.111 -0.993 . . . . 0.0 109.324 179.585 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HG3' ' A' ' 57' ' ' MET . 0.0 OUTLIER 62.71 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.625 -0.672 . . . . 0.0 110.639 179.352 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.5 p -50.64 -29.94 12.28 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.7 -1.25 . . . . 0.0 109.799 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.846 ' C ' HD23 ' A' ' 27' ' ' LEU . 9.6 mt-10 -66.2 -42.54 88.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.04 -1.038 . . . . 0.0 108.274 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.928 HD23 ' CE1' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -54.12 -60.74 2.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.083 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.833 ' HD2' HG11 ' A' ' 53' ' ' VAL . 0.1 OUTLIER -42.71 -53.07 4.69 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.332 -0.855 . . . . 0.0 109.798 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.36 -51.2 11.51 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.238 -0.913 . . . . 0.0 109.705 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.993 HD23 ' HG3' ' A' ' 39' ' ' GLU . 0.3 OUTLIER -57.35 -55.61 32.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.329 -0.857 . . . . 0.0 109.925 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.811 HD13 HG11 ' A' ' 80' ' ' VAL . 68.0 mt -64.61 -9.36 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.188 -0.945 . . . . 0.0 109.966 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 33' ' ' LYS . 9.2 m120 -91.31 -74.43 0.5 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.076 -1.015 . . . . 0.0 109.563 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -62.02 -12.44 18.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.689 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.993 ' HG3' HD23 ' A' ' 35' ' ' LEU . 6.1 mm-40 -110.83 -44.47 3.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.162 -0.961 . . . . 0.0 109.698 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.061 HD22 HD21 ' A' ' 44' ' ' LEU . 1.9 mt -108.4 64.94 0.62 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.128 -0.983 . . . . 0.0 109.472 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -110.76 -5.5 14.96 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.328 -0.857 . . . . 0.0 109.558 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -88.69 -77.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.217 -0.927 . . . . 0.0 109.445 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.17 -26.83 30.11 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.241 -0.912 . . . . 0.0 109.453 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 1.061 HD21 HD22 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -142.88 78.66 1.62 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.5 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.473 ' HA ' ' O ' ' A' ' 41' ' ' SER . 35.5 tt0 -43.82 102.95 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.435 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 45' ' ' GLU . 3.1 mt-10 47.91 -174.87 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 109.37 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.74 HG21 HG12 ' A' ' 53' ' ' VAL . 2.5 mm -93.03 124.78 45.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.178 -0.951 . . . . 0.0 109.514 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -67.65 0.23 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.285 -0.885 . . . . 0.0 109.253 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 1.9 tt0 -139.45 42.2 2.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 109.238 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.767 ' HA ' HG12 ' A' ' 53' ' ' VAL . 0.2 OUTLIER 68.62 56.5 0.45 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.311 -0.868 . . . . 0.0 109.34 -179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -88.64 -70.35 0.65 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -0.933 . . . . 0.0 109.543 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.862 ' O ' HG13 ' A' ' 56' ' ' VAL . 5.4 t -88.0 -23.36 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.13 -0.981 . . . . 0.0 109.289 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.833 HG11 ' HD2' ' A' ' 33' ' ' LYS . 2.8 p -72.5 -32.05 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.012 -1.055 . . . . 0.0 108.731 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.458 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 23.0 t0 -90.37 -37.21 14.15 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.465 -0.772 . . . . 0.0 109.139 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 1.1 ttmt -68.43 -31.82 71.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.335 -0.853 . . . . 0.0 109.427 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.985 ' HB ' HD13 ' A' ' 60' ' ' LEU . 3.7 m -57.99 -49.69 80.46 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 O-C-N 121.224 -0.923 . . . . 0.0 109.703 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.486 ' HG3' ' HG2' ' A' ' 29' ' ' LYS . 3.0 mmt -43.45 -26.88 0.23 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.807 -1.183 . . . . 0.0 109.496 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -78.37 -45.83 21.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.293 -0.879 . . . . 0.0 108.967 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.46 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 15.5 m -86.63 -62.16 1.57 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 109.382 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.985 HD13 ' HB ' ' A' ' 56' ' ' VAL . 4.7 mp -40.1 -28.25 0.05 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.412 -0.805 . . . . 0.0 109.981 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' MET . 8.9 p-10 -48.75 113.21 0.73 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.113 -0.992 . . . . 0.0 109.405 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -78.96 -49.97 11.9 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.209 -0.932 . . . . 0.0 109.503 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -124.11 -13.79 7.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.225 -0.922 . . . . 0.0 109.822 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 65' ' ' ASP . . . 100.26 102.94 2.51 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.476 ' HB3' ' OE1' ' A' ' 67' ' ' GLU . 0.4 OUTLIER 167.31 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.311 -1.111 . . . . 0.0 108.519 -179.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.56 -20.23 25.33 Favored Glycine 0 N--CA 1.485 1.911 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB3' ' CE ' ' A' ' 26' ' ' LYS . 6.8 mt-10 -69.9 103.28 2.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -1.146 . . . . 0.0 109.133 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.537 ' CA ' ' HG2' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -69.94 124.11 23.21 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.263 -0.898 . . . . 0.0 109.754 -179.36 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 29.9 t0 -94.21 170.46 9.5 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.552 ' HB3' HG21 ' B' ' 82' ' ' THR . 0.3 OUTLIER -53.96 -51.62 63.29 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 110.214 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG2' ' CG ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -51.48 -34.66 36.63 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.21 -0.931 . . . . 0.0 109.453 -179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.671 ' OE2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.13 -27.74 42.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.164 -0.96 . . . . 0.0 109.8 -179.73 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.715 ' CE2' HD23 ' A' ' 10' ' ' LEU . 19.5 t80 -62.47 -49.74 74.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.001 -1.062 . . . . 0.0 108.571 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.782 ' SD ' ' HB2' ' B' ' 78' ' ' ALA . 0.0 OUTLIER -63.15 -41.67 99.31 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.51 ' HA ' ' SD ' ' B' ' 74' ' ' MET . . . -72.4 -12.07 60.96 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.928 ' CE1' HD23 ' A' ' 32' ' ' LEU . 6.7 t80 -71.58 -70.05 0.35 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.971 HG21 ' HG ' ' B' ' 3' ' ' LEU . 44.1 t -69.22 -25.46 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.143 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.576 ' CB ' ' HB3' ' B' ' 74' ' ' MET . . . -69.12 -34.49 75.13 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.472 -0.768 . . . . 0.0 109.527 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.722 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.2 OUTLIER -79.12 -70.73 0.48 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.178 -0.951 . . . . 0.0 108.876 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.811 HG11 HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -44.46 -24.36 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 O-C-N 120.593 -1.317 . . . . 0.0 109.512 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.465 ' N ' ' O ' ' A' ' 79' ' ' MET . 8.2 m -78.56 -69.02 0.59 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.023 -1.048 . . . . 0.0 108.599 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.5 t -79.09 -50.1 11.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.944 . . . . 0.0 108.659 179.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.46 -40.41 0.56 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.329 0.585 . . . . 0.0 109.619 179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 1.5 t -90.08 -31.97 16.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.516 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.448 ' HB2' ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -64.64 -11.34 34.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.428 ' OE1' ' O ' ' A' ' 83' ' ' ALA . 11.8 pt-20 -65.4 -13.71 59.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -82.36 -22.67 35.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.231 -0.918 . . . . 0.0 109.466 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -84.63 -18.28 35.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.897 . . . . 0.0 109.477 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 89' ' ' GLU . 19.0 pt-20 -105.68 50.78 0.77 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.481 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -143.42 129.06 19.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 0.0 109.448 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.48 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.486 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 14.9 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.988 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 0.2 OUTLIER -53.54 -60.44 3.3 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.254 -0.903 . . . . 0.0 109.588 -179.983 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.971 ' HG ' HG21 ' A' ' 77' ' ' VAL . 3.6 mm? -69.51 -18.36 63.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.22 -0.925 . . . . 0.0 109.54 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' B' ' 1' ' ' SER . 0.6 OUTLIER -64.44 -63.4 1.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.383 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.91 -42.69 94.45 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.325 -0.859 . . . . 0.0 109.41 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -64.51 -23.13 67.17 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.237 -0.914 . . . . 0.0 109.509 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.475 ' O ' HG12 ' B' ' 11' ' ' ILE . 2.6 ttp -81.97 -29.75 32.01 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.57 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.43 HG23 ' O ' ' B' ' 4' ' ' GLU . 47.1 t -72.52 -35.81 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.642 ' HB1' ' CA ' ' A' ' 2' ' ' GLU . . . -74.62 -52.23 12.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 109.499 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.98 HD23 ' CE2' ' B' ' 73' ' ' PHE . 0.1 OUTLIER -57.33 -45.96 83.73 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.207 -0.933 . . . . 0.0 109.485 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.856 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 15.1 mm -55.07 -49.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -65.97 -20.54 66.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 1.065 HG21 HD21 ' A' ' 3' ' ' LEU . 0.9 OUTLIER -76.33 -39.06 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -0.898 . . . . 0.0 109.38 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.562 ' CE2' ' O ' ' B' ' 25' ' ' HIS . 25.0 t80 -67.87 -46.4 71.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.956 -1.09 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.471 ' O ' ' HB2' ' B' ' 18' ' ' SER . 4.8 m80 -64.92 -54.59 28.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.306 -0.871 . . . . 0.0 109.66 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -56.14 -65.09 0.66 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.206 -0.934 . . . . 0.0 109.501 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.673 ' CZ ' HD12 ' B' ' 35' ' ' LEU . 39.1 m-85 -53.1 -20.39 3.68 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.282 -0.886 . . . . 0.0 109.474 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' B' ' 15' ' ' HIS . 0.5 OUTLIER -71.88 -50.63 27.66 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.722 -179.781 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' B' ' 23' ' ' ASP . . . -90.5 53.78 3.45 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.516 ' CG ' ' HA ' ' B' ' 17' ' ' TYR . 15.0 mmm180 -90.2 -46.91 8.13 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -1.167 . . . . 0.0 109.603 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -139.1 81.47 1.84 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.177 -0.952 . . . . 0.0 109.85 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' B' ' 23' ' ' ASP . . . 85.5 -93.0 1.8 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' B' ' 18' ' ' SER . 16.2 m-20 -42.18 150.34 0.13 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.372 -1.075 . . . . 0.0 109.736 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.483 ' O ' ' CG ' ' B' ' 24' ' ' LYS . 1.9 tmmt? -144.12 58.56 1.35 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.562 ' O ' ' CE2' ' B' ' 14' ' ' PHE . 33.8 t60 -170.23 -35.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 109.479 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.538 ' CB ' ' HB3' ' B' ' 67' ' ' GLU . 0.0 OUTLIER -122.54 169.98 10.46 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 109.38 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.518 ' HB3' ' CB ' ' B' ' 31' ' ' GLU . 28.8 mt -119.34 127.81 53.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.184 -0.947 . . . . 0.0 110.325 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -74.53 153.37 39.1 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 178.375 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.524 ' N ' ' HG3' ' B' ' 28' ' ' LYS . 16.4 ttmt -36.86 -31.33 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.425 -0.797 . . . . 0.0 109.728 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.507 ' N ' ' O ' ' B' ' 28' ' ' LYS . 2.8 t -72.35 -52.36 16.48 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.335 -0.853 . . . . 0.0 109.314 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.518 ' CB ' ' HB3' ' B' ' 27' ' ' LEU . 0.4 OUTLIER -49.0 -44.95 41.71 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.115 -0.991 . . . . 0.0 108.553 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.52 HD21 ' CB ' ' B' ' 68' ' ' CYS . 28.7 mt -51.87 -67.13 0.28 Allowed 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.63 ' CG ' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.01 -28.92 0.09 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.416 -0.803 . . . . 0.0 109.789 179.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.439 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.0 OUTLIER -70.06 -60.07 2.52 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.176 -0.952 . . . . 0.0 109.411 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.892 HD21 ' CE1' ' B' ' 73' ' ' PHE . 11.9 tp -45.36 -48.44 13.33 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.338 -0.851 . . . . 0.0 109.654 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.89 HD13 HG11 ' B' ' 80' ' ' VAL . 31.1 mt -66.49 -34.64 71.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.213 -0.929 . . . . 0.0 109.562 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.627 ' ND2' HD11 ' B' ' 47' ' ' ILE . 1.9 m-80 -86.14 7.15 26.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -0.903 . . . . 0.0 109.597 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.512 ' CB ' ' OH ' ' B' ' 17' ' ' TYR . 4.4 m-80 -105.21 -46.85 4.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.687 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.526 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . 40.6 mp0 -124.9 -10.43 7.19 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.795 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.699 HD21 HG23 ' B' ' 81' ' ' THR . 0.1 OUTLIER -102.47 -4.49 25.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.161 -0.962 . . . . 0.0 109.55 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -10.44 27.37 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.971 . . . . 0.0 109.483 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -77.01 -44.52 30.6 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . 0.537 ' O ' HD23 ' B' ' 44' ' ' LEU . 0.2 OUTLIER -93.95 17.44 12.25 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.309 -0.869 . . . . 0.0 109.375 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.68 HD11 HD12 ' B' ' 40' ' ' LEU . 5.6 mt -141.41 101.33 3.98 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.281 -0.887 . . . . 0.0 109.358 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -65.59 87.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.238 -0.914 . . . . 0.0 109.528 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.476 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 2.3 tt0 66.38 30.25 8.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.934 . . . . 0.0 109.415 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.739 HG22 ' O ' ' B' ' 49' ' ' GLU . 35.0 mm 65.22 9.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.294 -0.879 . . . . 0.0 109.763 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.55 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER 36.19 44.68 0.29 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.671 -0.643 . . . . 0.0 109.846 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.739 ' O ' HG22 ' B' ' 47' ' ' ILE . 1.6 pt-20 86.54 -172.47 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.528 ' CG ' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -85.07 63.92 8.39 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.012 -1.055 . . . . 0.0 109.539 -179.788 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.422 ' HB3' ' HE2' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -90.64 -70.45 0.68 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.152 -179.731 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.866 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.5 t -88.64 -25.0 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.102 -0.999 . . . . 0.0 109.623 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.63 HG11 ' CG ' ' B' ' 33' ' ' LYS . 2.5 t -72.46 -29.62 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 O-C-N 120.983 -1.073 . . . . 0.0 108.228 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.452 ' HB2' ' HB2' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.79 -42.13 10.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.303 -0.873 . . . . 0.0 109.123 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -33.56 76.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.349 -0.844 . . . . 0.0 109.589 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.939 ' HB ' HD13 ' B' ' 60' ' ' LEU . 2.9 m -52.55 -55.25 11.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.593 ' H ' HG23 ' B' ' 56' ' ' VAL . 2.5 tpt -40.17 -34.28 0.3 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.072 -1.017 . . . . 0.0 109.692 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.23 -56.83 10.58 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.257 -0.902 . . . . 0.0 108.772 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.719 HG21 ' SD ' ' B' ' 79' ' ' MET . 4.9 m -76.53 -65.5 0.92 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.356 -0.84 . . . . 0.0 108.864 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 1.046 HD21 ' CG ' ' B' ' 76' ' ' PHE . 4.6 mp -32.44 -38.1 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.308 0.575 . . . . 0.0 110.258 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 59' ' ' THR . 37.9 t0 -84.92 71.43 10.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.907 . . . . 0.0 109.507 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -86.99 -10.42 53.2 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 109.429 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.51 -41.64 9.24 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.23 -0.919 . . . . 0.0 109.444 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.74 89.58 1.96 Allowed Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 175.54 -31.97 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.313 -1.11 . . . . 0.0 108.662 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.09 -32.18 6.89 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CB ' ' B' ' 26' ' ' LYS . 3.6 mm-40 -69.93 126.82 30.82 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.339 -1.094 . . . . 0.0 109.31 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.575 ' CA ' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -78.47 130.57 36.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.087 -1.008 . . . . 0.0 109.561 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' B' ' 72' ' ' GLU . 0.8 OUTLIER -105.26 170.39 7.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.269 -0.894 . . . . 0.0 109.286 179.708 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.856 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 0.9 OUTLIER -49.4 -55.98 11.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.99 -1.069 . . . . 0.0 110.511 -179.742 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.588 ' O ' ' HE3' ' B' ' 74' ' ' MET . 2.3 mt-30 -50.82 -32.63 20.71 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.177 -0.952 . . . . 0.0 109.73 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.887 ' OE1' HD23 ' B' ' 60' ' ' LEU . 0.0 OUTLIER -75.78 -32.71 60.02 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.948 -1.095 . . . . 0.0 109.543 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.98 ' CE2' HD23 ' B' ' 10' ' ' LEU . 3.0 t80 -62.66 -53.58 52.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.174 -0.954 . . . . 0.0 108.91 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.588 ' HE3' ' O ' ' B' ' 71' ' ' GLN . 0.0 OUTLIER -55.28 -46.96 76.15 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.541 -0.725 . . . . 0.0 109.795 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.986 ' HB1' ' CE ' ' B' ' 79' ' ' MET . . . -75.16 -14.28 60.54 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.075 -1.016 . . . . 0.0 109.195 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 1.046 ' CG ' HD21 ' B' ' 60' ' ' LEU . 1.9 t80 -71.83 -70.24 0.34 Allowed 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.396 -0.815 . . . . 0.0 109.317 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.47 -46.14 93.1 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.589 -0.694 . . . . 0.0 109.609 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.782 ' HB2' ' SD ' ' A' ' 74' ' ' MET . . . -51.99 -41.41 62.15 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.439 -0.788 . . . . 0.0 110.551 -179.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.986 ' CE ' ' HB1' ' B' ' 75' ' ' ALA . 12.6 mtm -69.83 -69.68 0.33 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.76 -1.213 . . . . 0.0 109.059 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.89 HG11 HD13 ' B' ' 36' ' ' ILE . 0.1 OUTLIER -42.49 -23.96 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 120.867 -1.146 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.699 HG23 HD21 ' B' ' 40' ' ' LEU . 0.6 OUTLIER -77.54 -68.77 0.59 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.832 -1.168 . . . . 0.0 108.899 178.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.581 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -78.18 -49.95 12.86 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.138 -0.976 . . . . 0.0 108.367 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.77 -43.25 0.42 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 121.235 0.54 . . . . 0.0 109.846 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.466 ' SG ' ' HE3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -90.17 -31.94 16.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.532 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' B' ' 82' ' ' THR . 0.8 OUTLIER -50.99 -34.59 29.68 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.285 -0.885 . . . . 0.0 109.584 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -46.67 -45.89 19.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.241 -0.912 . . . . 0.0 109.428 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.413 ' O ' ' C ' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -46.38 -51.25 15.27 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.495 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.413 ' C ' ' O ' ' B' ' 87' ' ' PHE . 1.9 t80 -43.97 -69.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.477 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' B' ' 90' ' ' HIS . 0.0 OUTLIER -133.43 161.85 33.45 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.273 -0.892 . . . . 0.0 109.517 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.456 ' HB2' ' O ' ' B' ' 89' ' ' GLU . 0.0 OUTLIER 71.17 56.66 0.21 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -0.894 . . . . 0.0 109.483 -179.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . 0.402 ' HG2' ' HA ' ' B' ' 87' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.437 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.553 ' HA ' ' HB1' ' B' ' 9' ' ' ALA . 1.5 tp10 -64.58 -77.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.544 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.758 HD13 HG21 ' B' ' 13' ' ' VAL . 7.2 mp -71.5 -30.17 65.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -56.32 -57.64 11.41 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.217 -0.927 . . . . 0.0 109.459 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.7 OUTLIER -62.03 -40.15 94.74 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.464 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.639 ' CB ' HD23 ' B' ' 10' ' ' LEU . . . -66.45 -17.06 64.58 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.464 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.524 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 36.3 ttp -84.46 -36.19 22.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.274 -0.891 . . . . 0.0 109.514 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 t -68.03 -42.0 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.184 -0.948 . . . . 0.0 109.522 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HB1' ' HA ' ' B' ' 2' ' ' GLU . . . -77.32 -59.78 2.64 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.525 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 85.4 mt -47.77 -48.71 30.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.555 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.75 HD13 ' CZ ' ' A' ' 70' ' ' PHE . 23.6 mm -57.78 -48.14 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 3.1 t0 -62.98 -19.65 64.51 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.916 . . . . 0.0 109.554 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.827 HG21 ' CD1' ' B' ' 3' ' ' LEU . 2.4 t -80.65 -29.72 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.241 -0.912 . . . . 0.0 109.301 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.493 ' O ' ' HB2' ' A' ' 18' ' ' SER . 15.1 t80 -73.73 -45.07 54.34 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.003 -1.061 . . . . 0.0 109.295 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.546 ' CE1' ' HD3' ' A' ' 24' ' ' LYS . 4.9 t60 -78.79 -29.36 44.93 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.301 -0.875 . . . . 0.0 109.617 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.509 ' CB ' ' O ' ' A' ' 12' ' ' ASP . 1.6 tt0 -75.8 -62.25 1.65 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.494 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.506 ' CD1' HG13 ' A' ' 13' ' ' VAL . 27.9 m-85 -55.82 -48.09 76.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 14' ' ' PHE . 1.2 t -67.62 -20.04 65.3 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.222 -0.923 . . . . 0.0 109.427 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.469 ' HA2' ' O ' ' A' ' 23' ' ' ASP . . . -89.75 17.61 51.74 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -88.61 -57.53 2.88 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -1.166 . . . . 0.0 109.448 -179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -113.53 140.4 48.17 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.221 -0.924 . . . . 0.0 109.449 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.24 -119.11 4.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.491 ' O ' ' CB ' ' A' ' 24' ' ' LYS . 4.2 m-20 -122.25 -80.67 0.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.224 -1.162 . . . . 0.0 109.463 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.565 ' O ' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER 165.51 99.67 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.499 -179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CD2' ' O ' ' A' ' 24' ' ' LYS . 55.1 m-70 -164.24 -41.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.542 ' CD ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -142.35 170.31 15.94 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.241 -0.912 . . . . 0.0 109.446 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.709 HD22 ' HB3' ' A' ' 31' ' ' GLU . 75.1 mt -112.01 134.26 53.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.92 . . . . 0.0 109.823 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 29' ' ' LYS . 3.6 mttt -81.79 165.16 21.14 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 28' ' ' LYS . 11.1 ptpt -45.0 -26.29 0.41 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.11 -0.994 . . . . 0.0 109.141 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 28' ' ' LYS . 4.9 p -82.43 -42.94 17.92 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.3 -0.875 . . . . 0.0 110.039 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HB3' HD22 ' A' ' 27' ' ' LEU . 36.4 mm-40 -56.84 -42.91 80.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.972 -1.08 . . . . 0.0 108.666 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.839 HD21 ' SG ' ' A' ' 68' ' ' CYS . 29.8 mt -62.66 -62.74 1.53 Allowed 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.886 ' HG3' HG11 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -40.62 -28.44 0.07 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.415 -0.803 . . . . 0.0 109.677 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -70.97 -58.36 3.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.441 179.709 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.852 HD22 HD21 ' B' ' 3' ' ' LEU . 12.6 mt -51.88 -39.58 59.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.278 -0.888 . . . . 0.0 109.736 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.826 HG22 HD22 ' A' ' 44' ' ' LEU . 0.9 OUTLIER -74.26 -29.17 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.44 ' OD1' ' HG3' ' A' ' 46' ' ' GLU . 1.8 m-80 -88.77 -3.14 58.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.93 . . . . 0.0 109.599 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -102.33 -45.91 4.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.188 -0.945 . . . . 0.0 109.512 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.515 ' HG3' ' N ' ' B' ' 4' ' ' GLU . 0.6 OUTLIER -106.14 -18.32 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.732 HD23 HD13 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -115.12 72.48 0.8 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.391 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -118.29 -7.82 10.67 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 109.502 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.89 -85.43 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.167 -0.958 . . . . 0.0 109.41 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -69.96 -30.89 68.36 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.298 -0.876 . . . . 0.0 109.345 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.826 HD22 HG22 ' A' ' 36' ' ' ILE . 4.1 mp -77.05 -29.72 55.27 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.436 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 44' ' ' LEU . 8.9 pt-20 40.15 71.33 0.19 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.505 -0.747 . . . . 0.0 109.835 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.516 ' CG ' ' O ' ' A' ' 46' ' ' GLU . 1.3 tt0 44.14 46.17 7.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.222 -0.924 . . . . 0.0 109.331 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.828 HG13 HG21 ' A' ' 53' ' ' VAL . 0.9 OUTLIER 51.54 -147.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.237 -0.914 . . . . 0.0 109.161 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 47' ' ' ILE . 8.9 pttt 173.81 -49.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.147 -0.97 . . . . 0.0 109.24 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.425 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -131.5 21.19 4.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.371 -0.831 . . . . 0.0 109.062 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 1.2 mp0 65.48 59.62 0.78 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.385 -0.822 . . . . 0.0 109.32 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -89.7 -70.36 0.67 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.254 -0.904 . . . . 0.0 109.522 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.785 ' O ' HG22 ' A' ' 56' ' ' VAL . 1.5 t -86.2 -21.13 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.169 -0.957 . . . . 0.0 109.313 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.886 HG11 ' HG3' ' A' ' 33' ' ' LYS . 89.8 t -76.63 -28.37 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.036 . . . . 0.0 109.114 179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.501 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 28.9 t0 -90.16 -34.88 15.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.289 -0.882 . . . . 0.0 109.448 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -40.81 62.5 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.216 -0.928 . . . . 0.0 109.692 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.785 HG22 ' O ' ' A' ' 52' ' ' VAL . 34.9 m -62.65 -49.44 83.75 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 O-C-N 121.075 -1.015 . . . . 0.0 109.622 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.616 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 13.2 tpp -41.98 -25.94 0.08 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.725 -1.234 . . . . 0.0 109.49 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.492 ' N ' ' O ' ' A' ' 56' ' ' VAL . 1.4 tm-20 -79.72 -50.95 9.84 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.071 -1.018 . . . . 0.0 109.935 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.566 ' CG2' ' N ' ' A' ' 60' ' ' LEU . 2.3 t -77.7 -52.88 8.25 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.899 -1.126 . . . . 0.0 109.782 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.611 HD22 ' HB2' ' A' ' 76' ' ' PHE . 20.4 mt -40.54 -52.67 2.81 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -71.96 113.28 8.83 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.376 -0.828 . . . . 0.0 109.557 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -110.26 25.73 11.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.335 -0.853 . . . . 0.0 109.38 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.0 -37.01 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.262 -0.898 . . . . 0.0 109.461 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . 91.42 73.97 1.27 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 64' ' ' GLY . 0.7 OUTLIER -177.39 30.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -1.154 . . . . 0.0 108.471 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 49.51 63.83 3.82 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.542 ' HB2' ' CD ' ' A' ' 26' ' ' LYS . 3.6 pt-20 -162.96 110.85 1.26 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.326 -1.103 . . . . 0.0 109.298 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.839 ' SG ' HD21 ' A' ' 32' ' ' LEU . 1.8 m -69.59 167.58 16.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' GLU . 0.4 OUTLIER -127.4 172.11 10.94 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.75 ' CZ ' HD13 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.18 -62.13 2.07 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.648 -1.282 . . . . 0.0 110.352 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.961 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 5.0 pt20 -48.08 -27.08 2.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.151 -0.968 . . . . 0.0 108.845 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.549 ' CG ' ' HB3' ' A' ' 60' ' ' LEU . 2.5 tm-20 -74.82 -42.8 57.36 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.633 -0.667 . . . . 0.0 109.695 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.786 ' HE1' HD13 ' A' ' 35' ' ' LEU . 32.4 t80 -54.02 -46.85 71.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.317 -0.864 . . . . 0.0 109.611 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 1.075 ' HB3' ' HB2' ' B' ' 78' ' ' ALA . 1.6 tpp -63.8 -54.63 32.06 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 109.336 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.738 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . . . -64.46 -10.62 26.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.241 -0.912 . . . . 0.0 109.534 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.695 ' CE1' HG21 ' A' ' 80' ' ' VAL . 0.2 OUTLIER -74.39 -64.02 1.11 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.664 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.578 ' HB ' ' HE2' ' B' ' 74' ' ' MET . 87.0 t -58.2 -23.8 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.897 ' HB2' ' CB ' ' B' ' 74' ' ' MET . . . -66.67 -40.76 88.75 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.525 -0.734 . . . . 0.0 109.19 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.709 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 0.1 OUTLIER -77.75 -70.95 0.44 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.271 -0.893 . . . . 0.0 109.512 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.721 ' HB ' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -44.05 -24.67 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 120.502 -1.374 . . . . 0.0 110.035 -179.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.487 ' CB ' ' O ' ' A' ' 77' ' ' VAL . 16.2 m -79.64 -66.73 0.84 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.919 -1.113 . . . . 0.0 108.433 178.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.547 ' OG1' ' CG ' ' B' ' 70' ' ' PHE . 1.9 m -78.4 -53.9 6.76 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -36.88 -44.32 0.49 Allowed 'General case' 0 N--CA 1.494 1.765 0 CA-C-O 121.259 0.552 . . . . 0.0 109.782 179.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.02 -47.43 65.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.564 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -63.27 -12.06 26.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.288 -0.883 . . . . 0.0 109.518 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -90.02 -31.86 17.01 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.42 ' O ' ' C ' ' A' ' 88' ' ' PHE . 0.2 OUTLIER -69.65 -27.78 65.34 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.454 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.453 ' CD1' ' O ' ' A' ' 89' ' ' GLU . 61.7 t80 -44.17 -66.99 0.32 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.428 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.453 ' O ' ' CD1' ' A' ' 88' ' ' PHE . 0.7 OUTLIER 44.43 -163.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.278 -0.889 . . . . 0.0 109.508 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -106.69 50.75 0.76 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 109.478 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.466 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' B' ' 5' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.691 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.19 -70.74 0.11 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.167 -0.958 . . . . 0.0 109.791 -179.797 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.852 HD21 HD22 ' A' ' 35' ' ' LEU . 7.8 mp -74.64 -37.81 62.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.077 -1.014 . . . . 0.0 109.809 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -52.7 -62.39 1.68 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.952 . . . . 0.0 109.547 -179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.538 ' O ' HG12 ' B' ' 8' ' ' VAL . 0.0 OUTLIER -60.94 -47.72 85.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.292 -0.88 . . . . 0.0 109.646 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.594 ' HB1' ' HB1' ' A' ' 6' ' ' ALA . . . -60.82 -13.8 17.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.239 -0.913 . . . . 0.0 109.627 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.621 ' O ' HD12 ' B' ' 11' ' ' ILE . 42.6 ttp -83.72 -49.34 9.22 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.51 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.538 HG12 ' O ' ' B' ' 5' ' ' LYS . 5.8 p -61.6 -34.28 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.285 -0.884 . . . . 0.0 109.648 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.553 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . -73.33 -60.25 2.33 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.538 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.639 HD23 ' CB ' ' A' ' 6' ' ' ALA . 2.0 mm? -44.01 -49.54 8.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.42 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.621 HD12 ' O ' ' B' ' 7' ' ' MET . 13.6 mt -57.53 -47.97 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.233 -0.917 . . . . 0.0 109.548 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' B' ' 16' ' ' GLN . 0.2 OUTLIER -51.34 -27.71 10.42 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.923 . . . . 0.0 109.474 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.846 ' CG1' HD21 ' B' ' 35' ' ' LEU . 2.1 t -84.79 -33.18 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 109.511 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 5.2 t80 -61.2 -49.11 78.49 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.882 -1.136 . . . . 0.0 109.471 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 -78.06 -37.57 46.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.281 -0.887 . . . . 0.0 109.738 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' B' ' 12' ' ' ASP . 1.4 tp60 -60.07 -67.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.556 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.555 ' CD1' HG13 ' B' ' 13' ' ' VAL . 53.0 m-85 -57.99 -54.11 50.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' B' ' 14' ' ' PHE . 6.4 m -62.82 -12.7 26.28 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.259 -0.901 . . . . 0.0 109.589 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.88 -21.33 26.12 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.439 ' HB3' ' OE2' ' B' ' 21' ' ' GLU . 5.0 mmt180 -54.95 -47.04 75.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -1.117 . . . . 0.0 109.501 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.439 ' OE2' ' HB3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -168.83 147.98 4.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.491 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.77 -111.24 2.07 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.448 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -107.98 -78.76 0.58 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.204 -1.174 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER 168.56 -35.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.577 ' O ' ' CZ ' ' B' ' 14' ' ' PHE . 26.8 m80 -115.95 18.13 15.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.913 . . . . 0.0 109.429 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.489 ' HD2' ' HB2' ' B' ' 67' ' ' GLU . 30.5 mtmt -144.5 152.99 41.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.95 HD21 HD12 ' B' ' 35' ' ' LEU . 3.5 mp -93.59 142.77 26.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.129 -0.982 . . . . 0.0 109.739 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.589 ' O ' ' N ' ' B' ' 30' ' ' SER . 0.2 OUTLIER -98.78 86.29 3.49 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.365 -0.835 . . . . 0.0 109.099 179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 43.39 -86.18 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.43 -0.794 . . . . 0.0 110.826 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.589 ' N ' ' O ' ' B' ' 28' ' ' LYS . 39.1 t -47.82 -33.12 6.87 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.298 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.884 ' C ' HD23 ' B' ' 27' ' ' LEU . 0.1 OUTLIER -56.25 -44.25 79.48 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.795 -1.19 . . . . 0.0 109.216 -179.784 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.631 HD23 HD22 ' B' ' 27' ' ' LEU . 5.2 mt -65.33 -52.82 51.32 Favored 'General case' 0 C--N 1.297 -1.712 0 O-C-N 121.479 -0.763 . . . . 0.0 109.124 179.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.82 ' HG2' HG11 ' B' ' 53' ' ' VAL . 0.0 OUTLIER -41.89 -64.27 0.61 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.39 -0.819 . . . . 0.0 109.884 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.544 ' HG3' ' CE2' ' B' ' 17' ' ' TYR . 5.0 pt-20 -47.34 -56.37 6.99 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.128 -0.983 . . . . 0.0 109.69 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.95 HD12 HD21 ' B' ' 27' ' ' LEU . 2.8 mt -43.51 -39.04 3.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.212 -0.93 . . . . 0.0 109.771 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 1.05 HD12 HG22 ' B' ' 53' ' ' VAL . 0.5 OUTLIER -69.46 -52.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.252 -0.905 . . . . 0.0 109.529 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.731 HD21 HG21 ' B' ' 47' ' ' ILE . 40.5 m-80 -89.11 20.79 3.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 109.786 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' B' ' 34' ' ' GLU . 1.7 t30 -118.23 -36.12 3.65 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.973 . . . . 0.0 109.491 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 3' ' ' LEU . 10.1 mm-40 -121.18 -14.27 8.39 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.23 -0.918 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.803 ' HB3' HD11 ' B' ' 44' ' ' LEU . 1.1 mt -113.25 52.97 0.77 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 2.3 t -111.73 37.87 2.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.478 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -116.71 -78.63 0.58 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.476 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -79.91 -46.17 17.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.483 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.803 HD11 ' HB3' ' B' ' 40' ' ' LEU . 0.8 OUTLIER -92.58 54.01 2.18 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.236 -0.915 . . . . 0.0 109.553 -179.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -84.29 71.2 10.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.252 -0.905 . . . . 0.0 109.433 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' B' ' 47' ' ' ILE . 0.3 OUTLIER -137.35 -88.41 0.27 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.938 HG22 ' H ' ' B' ' 49' ' ' GLU . 26.8 mm 66.66 -83.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.487 -0.758 . . . . 0.0 109.828 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.588 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 0.0 OUTLIER 88.89 8.25 0.12 Allowed 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.564 -0.71 . . . . 0.0 109.495 -179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.938 ' H ' HG22 ' B' ' 47' ' ' ILE . 5.1 tt0 79.68 8.69 1.62 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.47 -0.769 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -176.19 21.25 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.73 -1.231 . . . . 0.0 111.475 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' B' ' 47' ' ' ILE . 51.5 tp10 -91.02 -70.74 0.67 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.488 -1.383 . . . . 0.0 109.331 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.775 ' O ' HG13 ' B' ' 56' ' ' VAL . 1.2 t -93.56 -19.38 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.261 -0.899 . . . . 0.0 108.666 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.05 HG22 HD12 ' B' ' 36' ' ' ILE . 4.7 t -78.91 -20.44 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.369 -0.832 . . . . 0.0 109.233 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -85.1 -37.42 20.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.437 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -40.04 30.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 109.422 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.775 HG13 ' O ' ' B' ' 52' ' ' VAL . 34.1 m -63.9 -46.07 95.18 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 O-C-N 121.211 -0.931 . . . . 0.0 109.62 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.589 ' N ' HG23 ' B' ' 56' ' ' VAL . 4.9 tpt -41.87 -27.46 0.12 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.06 -1.025 . . . . 0.0 109.591 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' B' ' 56' ' ' VAL . 0.2 OUTLIER -84.5 -42.84 15.15 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.235 -0.916 . . . . 0.0 108.913 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.451 ' O ' ' C ' ' B' ' 60' ' ' LEU . 31.8 m -75.92 -63.99 1.19 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.353 -0.842 . . . . 0.0 109.753 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.69 HD22 ' HB2' ' B' ' 76' ' ' PHE . 3.8 mt -41.24 -39.43 1.35 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.508 ' OD2' ' HE2' ' B' ' 57' ' ' MET . 50.2 m-20 -90.22 111.87 23.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.283 -0.885 . . . . 0.0 109.431 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' B' ' 72' ' ' GLU . 11.3 p-10 -95.99 -13.59 23.68 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.188 -0.945 . . . . 0.0 109.63 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.409 ' HB3' ' OE2' ' B' ' 67' ' ' GLU . 0.2 OUTLIER -105.73 -22.01 13.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.612 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' B' ' 65' ' ' ASP . . . 80.68 99.82 0.33 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . 0.495 ' CB ' ' O ' ' B' ' 64' ' ' GLY . 0.5 OUTLIER 164.87 -26.16 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.25 -1.147 . . . . 0.0 108.608 -179.787 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . 0.466 ' O ' ' HA ' ' B' ' 28' ' ' LYS . . . 110.56 23.44 5.97 Favored Glycine 0 N--CA 1.484 1.874 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' B' ' 67' ' ' GLU . 3.3 pt-20 -110.49 86.27 2.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.366 -1.079 . . . . 0.0 109.316 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' B' ' 72' ' ' GLU . 13.1 t -69.9 156.24 39.38 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.214 -0.929 . . . . 0.0 109.78 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.481 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.3 OUTLIER -118.71 171.42 8.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.438 -0.789 . . . . 0.0 108.996 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.633 ' CD2' ' CD2' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.45 -51.57 67.92 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.228 -0.92 . . . . 0.0 110.335 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.589 ' HA ' ' HB1' ' A' ' 78' ' ' ALA . 16.7 pt20 -57.39 -37.97 73.52 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.411 -0.805 . . . . 0.0 109.222 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.498 ' HG2' ' HG3' ' B' ' 71' ' ' GLN . 1.8 mt-10 -79.3 -15.72 57.51 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 109.445 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.596 ' CE2' HD12 ' B' ' 10' ' ' LEU . 5.8 t80 -71.05 -63.41 1.11 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 108.708 179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.897 ' CB ' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -60.56 -37.78 82.39 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.426 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.844 ' O ' ' HB3' ' B' ' 78' ' ' ALA . . . -59.58 -37.35 78.29 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.874 ' CE1' HG21 ' B' ' 80' ' ' VAL . 0.0 OUTLIER -57.59 -67.39 0.34 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.126 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.813 HG23 ' CE2' ' B' ' 76' ' ' PHE . 49.4 t -52.9 -21.95 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 1.075 ' HB2' ' HB3' ' A' ' 74' ' ' MET . . . -57.42 -58.0 10.18 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.482 -0.761 . . . . 0.0 108.953 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.701 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 27.0 mmm -70.82 -65.56 0.72 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.433 -0.792 . . . . 0.0 109.284 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.874 HG21 ' CE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -41.5 -25.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.762 0 O-C-N 120.655 -1.278 . . . . 0.0 110.12 -179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 11' ' ' ILE . 5.3 m -75.75 -70.13 0.45 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.886 -1.134 . . . . 0.0 108.673 178.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.3 t -79.11 -49.53 12.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.087 -1.008 . . . . 0.0 108.327 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -37.94 -44.0 0.75 Allowed 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.249 0.547 . . . . 0.0 109.789 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.527 ' HB3' ' CB ' ' B' ' 44' ' ' LEU . 0.5 OUTLIER -90.22 -27.92 19.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.268 -0.895 . . . . 0.0 109.702 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.573 ' O ' ' CD1' ' B' ' 88' ' ' PHE . 81.4 t60 -70.81 -9.34 57.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 109.727 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -9.56 55.88 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.214 -0.929 . . . . 0.0 109.724 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -46.86 85.17 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.0 109.808 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.573 ' CD1' ' O ' ' B' ' 85' ' ' HIS . 0.2 OUTLIER -55.55 -23.29 25.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.699 -179.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.55 ' N ' ' CD1' ' B' ' 88' ' ' PHE . 0.2 OUTLIER 47.42 -174.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.25 -0.906 . . . . 0.0 109.449 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -171.63 165.4 6.76 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.23 -0.918 . . . . 0.0 109.503 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.458 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.866 ' OE2' HG23 ' B' ' 13' ' ' VAL . 3.7 tt0 -62.03 -71.47 0.15 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -0.933 . . . . 0.0 109.493 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.964 HD13 HG21 ' B' ' 13' ' ' VAL . 7.4 mp -71.98 -33.99 68.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.555 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.55 ' OE2' ' CE1' ' B' ' 42' ' ' HIS . 1.6 tt0 -54.13 -61.7 2.13 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.219 -0.926 . . . . 0.0 109.492 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -61.56 -47.19 86.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.351 179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.964 ' O ' HD12 ' A' ' 10' ' ' LEU . . . -59.79 -15.28 19.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.279 -0.888 . . . . 0.0 109.375 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.768 ' HE3' HD11 ' B' ' 40' ' ' LEU . 2.9 tpp -82.25 -63.77 1.31 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.213 -0.929 . . . . 0.0 109.539 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.414 ' C ' ' O ' ' A' ' 7' ' ' MET . 19.1 t -44.27 -44.92 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.145 -0.972 . . . . 0.0 109.633 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.687 ' HB1' ' HG3' ' B' ' 2' ' ' GLU . . . -67.15 -60.14 2.86 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.247 -0.908 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.964 HD12 ' O ' ' A' ' 6' ' ' ALA . 3.5 mt -47.66 -70.26 0.1 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.212 -0.93 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.695 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 40.5 mt -41.65 -36.95 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.418 -0.801 . . . . 0.0 110.025 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.517 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 2.8 m-20 -60.6 -48.88 79.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.159 -0.963 . . . . 0.0 110.044 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.479 HG21 HD21 ' B' ' 3' ' ' LEU . 1.1 t -62.85 -28.55 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 35.4 t80 -67.51 -41.97 83.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.9 -1.125 . . . . 0.0 109.601 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -73.43 -34.35 65.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.29 -0.881 . . . . 0.0 110.019 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.517 ' CG ' ' O ' ' A' ' 12' ' ' ASP . 2.1 mt-30 -69.4 -63.31 1.09 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.062 -1.024 . . . . 0.0 109.678 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.783 ' CZ ' HD12 ' A' ' 35' ' ' LEU . 11.5 m-85 -49.88 -44.42 49.89 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.377 -0.827 . . . . 0.0 109.908 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -65.2 -32.84 74.73 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.146 -0.971 . . . . 0.0 109.52 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -60.21 -13.97 30.74 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.535 ' CD ' ' HA ' ' A' ' 17' ' ' TYR . 10.0 mtp85 -81.65 -32.84 31.69 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 109.527 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.47 ' OE1' ' HB2' ' A' ' 23' ' ' ASP . 0.1 OUTLIER -79.42 134.01 36.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.286 -0.884 . . . . 0.0 109.434 179.993 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.43 -24.91 1.81 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.47 ' HB2' ' OE1' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -72.11 -46.52 56.31 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.239 -1.153 . . . . 0.0 109.487 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 18' ' ' SER . 1.2 mttm 66.94 60.33 0.53 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.92 . . . . 0.0 109.43 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.439 ' HB3' ' HD3' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -170.23 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.217 -0.927 . . . . 0.0 109.759 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 68' ' ' CYS . 0.0 OUTLIER -142.65 169.93 16.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.158 -0.964 . . . . 0.0 109.783 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.883 HD22 ' HB3' ' A' ' 31' ' ' GLU . 22.0 mt -97.55 163.12 12.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.29 -0.881 . . . . 0.0 109.342 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' CG ' ' OE2' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -126.97 69.95 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.128 -0.983 . . . . 0.0 109.936 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 32' ' ' LEU . 16.5 tptm 63.85 -83.06 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.468 -0.77 . . . . 0.0 110.695 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.6 p -46.23 -41.42 12.85 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.146 -0.971 . . . . 0.0 110.273 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.883 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -62.28 -39.96 94.68 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.971 -1.08 . . . . 0.0 108.845 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 76' ' ' PHE . 70.0 mt -58.21 -71.05 0.12 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.777 -0.577 . . . . 0.0 109.459 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.706 ' CD ' HD11 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -43.89 -39.12 3.75 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.249 -0.907 . . . . 0.0 109.39 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -59.54 4.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.209 -0.932 . . . . 0.0 109.218 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.783 HD12 ' CZ ' ' A' ' 17' ' ' TYR . 13.4 tp -57.23 -55.54 33.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.418 -0.801 . . . . 0.0 109.404 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.916 HD11 ' CE1' ' A' ' 76' ' ' PHE . 2.2 mt -43.65 -29.0 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.36 -0.838 . . . . 0.0 109.254 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.506 ' ND2' ' O ' ' A' ' 45' ' ' GLU . 13.7 m120 -82.92 -40.63 19.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.251 -0.906 . . . . 0.0 109.812 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -95.31 21.22 8.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.187 -0.946 . . . . 0.0 109.777 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.985 ' HG3' HD12 ' A' ' 40' ' ' LEU . 22.8 pt-20 -129.52 -45.95 1.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.114 -0.992 . . . . 0.0 109.721 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.99 HD22 HD21 ' A' ' 44' ' ' LEU . 3.5 mp -76.67 -17.26 59.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.127 -0.983 . . . . 0.0 109.604 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 40' ' ' LEU . 1.7 t 79.13 54.94 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.443 -0.786 . . . . 0.0 110.724 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.484 ' CB ' ' O ' ' A' ' 41' ' ' SER . 8.0 m-70 74.48 -4.11 2.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.16 -0.963 . . . . 0.0 110.447 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.552 ' CB ' ' HB3' ' A' ' 40' ' ' LEU . 1.6 t80 -56.94 -18.51 13.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.888 -1.133 . . . . 0.0 108.677 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.99 HD21 HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -161.61 43.19 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.506 -0.746 . . . . 0.0 109.359 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.506 ' O ' ' ND2' ' A' ' 37' ' ' ASN . 0.0 OUTLIER -43.92 -77.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.206 -0.934 . . . . 0.0 109.509 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' A' ' 47' ' ' ILE . 0.9 OUTLIER -87.69 17.0 5.01 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.334 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.768 HG21 ' HA ' ' A' ' 50' ' ' GLN . 4.0 mt 60.17 120.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.3 -0.875 . . . . 0.0 109.39 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -44.69 -26.43 0.38 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.238 -0.914 . . . . 0.0 109.257 179.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER 172.96 49.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.314 -0.866 . . . . 0.0 109.271 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.768 ' HA ' HG21 ' A' ' 47' ' ' ILE . 4.1 mp0 44.15 48.38 7.62 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.23 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -90.12 -53.55 4.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.912 -179.667 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.997 HG11 ' HA ' ' A' ' 80' ' ' VAL . 3.0 t -96.05 -20.21 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.129 -0.982 . . . . 0.0 110.041 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.702 HG21 ' CE ' ' A' ' 33' ' ' LYS . 37.1 t -81.5 -30.33 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.772 -1.205 . . . . 0.0 108.698 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.468 ' HB2' ' HB3' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -90.01 -24.4 21.23 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.405 -0.809 . . . . 0.0 108.848 179.352 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.8 OUTLIER -82.59 -48.42 11.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.38 -0.825 . . . . 0.0 109.208 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.792 HG21 ' CE1' ' A' ' 76' ' ' PHE . 33.0 m -57.6 -44.77 85.89 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 O-C-N 121.158 -0.964 . . . . 0.0 109.26 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.584 ' N ' HG23 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -37.39 -30.87 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.483 -0.761 . . . . 0.0 109.632 -179.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 56' ' ' VAL . 0.2 OUTLIER -85.36 -44.99 12.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 56' ' ' VAL . 15.8 m -63.9 -65.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.831 HD13 ' CE2' ' A' ' 76' ' ' PHE . 3.3 mt -40.15 -66.76 0.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.444 -0.785 . . . . 0.0 109.602 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.412 ' OD2' ' HA2' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -45.76 94.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.45 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.512 ' N ' ' O ' ' A' ' 60' ' ' LEU . 2.1 m-20 -109.62 -5.14 15.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.555 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -100.61 -39.79 7.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.206 -0.934 . . . . 0.0 109.383 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 68.92 0.83 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -168.76 25.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -1.153 . . . . 0.0 108.6 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.412 ' HA2' ' OD2' ' A' ' 61' ' ' ASP . . . 49.11 27.63 7.27 Favored Glycine 0 N--CA 1.482 1.705 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.464 ' OE1' ' HG3' ' A' ' 26' ' ' LYS . 51.0 mm-40 -124.27 133.54 53.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.255 -1.144 . . . . 0.0 109.543 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.52 ' O ' ' CB ' ' A' ' 26' ' ' LYS . 15.7 t -78.02 158.95 29.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.275 -0.891 . . . . 0.0 109.614 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.486 ' N ' ' SG ' ' A' ' 68' ' ' CYS . 0.4 OUTLIER -127.21 171.63 11.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 108.877 179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.695 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -58.61 -54.02 51.77 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.293 -0.88 . . . . 0.0 110.488 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.435 ' HA ' ' HB1' ' B' ' 78' ' ' ALA . 1.2 pm0 -56.21 -29.71 61.31 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.093 -1.005 . . . . 0.0 108.887 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 6.8 mt-10 -80.13 -25.41 39.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.464 -0.773 . . . . 0.0 109.513 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.498 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 8.3 t80 -67.63 -55.65 12.46 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.307 -0.871 . . . . 0.0 108.83 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.539 ' HB2' ' CB ' ' B' ' 78' ' ' ALA . 8.9 mtt -61.34 -37.74 84.41 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.526 ' O ' ' CG ' ' A' ' 79' ' ' MET . . . -71.67 -19.9 62.02 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.47 -0.769 . . . . 0.0 109.018 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' HD11 ' A' ' 36' ' ' ILE . 0.2 OUTLIER -72.96 -69.56 0.41 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.792 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.914 HG22 ' CD ' ' A' ' 39' ' ' GLU . 42.0 t -54.61 -38.81 43.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.241 -0.912 . . . . 0.0 109.647 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.7 ' HB1' ' HB3' ' B' ' 74' ' ' MET . . . -65.76 -29.53 70.05 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.309 -0.869 . . . . 0.0 109.924 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 18.9 mmm -82.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.045 -1.034 . . . . 0.0 109.57 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.997 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -48.75 -20.81 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 O-C-N 120.399 -1.438 . . . . 0.0 109.709 -179.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.575 HG23 ' N ' ' A' ' 82' ' ' THR . 4.8 t -87.81 -50.93 6.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.795 -1.191 . . . . 0.0 109.371 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.586 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.2 t -90.32 -51.46 5.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.867 -1.145 . . . . 0.0 107.973 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -35.45 -37.04 0.08 Allowed 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.275 0.559 . . . . 0.0 109.946 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.415 ' N ' ' O ' ' A' ' 82' ' ' THR . 3.8 t -90.02 -38.04 13.88 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' A' ' 82' ' ' THR . 28.4 t60 -55.46 -18.33 6.86 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.222 -0.924 . . . . 0.0 109.489 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.512 ' O ' ' CB ' ' A' ' 90' ' ' HIS . 0.8 OUTLIER -57.54 -41.56 81.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.178 -0.951 . . . . 0.0 109.516 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -62.76 -43.69 98.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.225 -0.922 . . . . 0.0 109.52 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -54.24 -64.28 0.88 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.169 -0.957 . . . . 0.0 109.476 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -125.09 108.73 12.1 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.24 -0.913 . . . . 0.0 109.545 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.512 ' CB ' ' O ' ' A' ' 86' ' ' GLU . 83.8 t60 -168.69 142.47 3.07 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.314 -0.866 . . . . 0.0 109.489 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.414 ' OXT' ' O ' ' A' ' 90' ' ' HIS . 9.8 mm-40 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.019 -0.991 . . . . 0.0 109.511 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.52 ' N ' ' HB2' ' B' ' 4' ' ' GLU . 8.2 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.423 0.63 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . 0.687 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 1.6 tp10 -60.14 -63.26 1.36 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.36 -0.838 . . . . 0.0 109.598 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.697 ' CD1' HD23 ' A' ' 10' ' ' LEU . 3.3 mm? -75.88 -34.83 60.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.63 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.52 ' HB2' ' N ' ' B' ' 1' ' ' SER . 2.7 mm-40 -53.45 -61.98 1.95 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.236 -0.915 . . . . 0.0 109.63 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -60.73 -48.06 83.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.23 -0.919 . . . . 0.0 109.546 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.525 ' HA ' ' CB ' ' A' ' 6' ' ' ALA . . . -61.11 -14.13 22.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.278 -0.889 . . . . 0.0 109.664 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.545 ' SD ' HG12 ' A' ' 77' ' ' VAL . 1.6 mmt -83.05 -64.37 1.18 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 109.6 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.433 ' H ' HG23 ' B' ' 8' ' ' VAL . 3.2 t -51.35 -25.81 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.805 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -75.89 -57.84 3.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.207 -0.933 . . . . 0.0 109.6 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.491 HD13 HD11 ' A' ' 3' ' ' LEU . 0.8 OUTLIER -49.26 -39.31 30.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.215 -0.928 . . . . 0.0 109.639 -179.867 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.495 HD12 ' O ' ' B' ' 7' ' ' MET . 4.8 mt -70.46 -35.53 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.209 -0.932 . . . . 0.0 109.665 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' B' ' 16' ' ' GLN . 2.6 t70 -69.58 -16.17 63.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -0.931 . . . . 0.0 109.638 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.964 HG21 HD13 ' A' ' 3' ' ' LEU . 1.5 t -89.99 -37.99 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.457 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.556 ' CE1' ' SG ' ' B' ' 68' ' ' CYS . 46.1 t80 -66.95 -42.08 85.86 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.866 -1.147 . . . . 0.0 109.341 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.602 ' HA ' ' HG ' ' B' ' 18' ' ' SER . 0.1 OUTLIER -78.85 -49.79 12.33 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.497 ' CB ' ' O ' ' B' ' 12' ' ' ASP . 30.1 tt0 -53.98 -59.69 4.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.245 -0.909 . . . . 0.0 109.504 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.787 ' CG ' HD21 ' B' ' 35' ' ' LEU . 45.5 m-85 -60.43 -47.57 85.55 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.233 -0.917 . . . . 0.0 109.62 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.602 ' HG ' ' HA ' ' B' ' 15' ' ' HIS . 97.6 p -61.77 -14.98 37.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.193 -0.942 . . . . 0.0 109.589 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.26 -31.27 66.32 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' B' ' 17' ' ' TYR . 1.4 mtt-85 -77.33 -10.9 59.72 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -1.128 . . . . 0.0 109.404 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' HG3' ' B' ' 26' ' ' LYS . 0.0 OUTLIER -79.66 170.02 17.15 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.67 -35.51 35.95 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.498 ' CB ' ' HD2' ' B' ' 26' ' ' LYS . 2.5 t0 -75.38 -24.05 57.17 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -1.119 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 23' ' ' ASP . 6.7 mttp 66.4 25.98 10.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 109.59 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . 0.533 ' HB3' ' CE ' ' B' ' 26' ' ' LYS . 0.3 OUTLIER -160.69 22.93 0.14 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.558 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.533 ' CE ' ' HB3' ' B' ' 25' ' ' HIS . 0.1 OUTLIER -168.67 169.03 10.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.24 -0.913 . . . . 0.0 109.513 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.803 HD13 ' SG ' ' B' ' 68' ' ' CYS . 7.7 mp -122.36 138.73 54.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.883 . . . . 0.0 109.786 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.537 ' CD ' ' OE2' ' B' ' 31' ' ' GLU . 0.2 OUTLIER -89.77 169.02 11.63 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.028 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.509 ' HA ' HD12 ' B' ' 32' ' ' LEU . 2.6 mtmt -42.14 -26.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.037 -1.04 . . . . 0.0 109.854 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.451 ' N ' ' O ' ' B' ' 28' ' ' LYS . 36.3 t -77.88 -51.92 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 110.97 -179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.609 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 0.1 OUTLIER -58.16 -38.58 76.88 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.76 -1.212 . . . . 0.0 109.026 -179.377 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.957 HD22 ' CD1' ' B' ' 60' ' ' LEU . 2.6 mt -58.8 -67.28 0.38 Allowed 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.469 -0.769 . . . . 0.0 108.94 179.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 1.005 ' HD3' HG11 ' B' ' 53' ' ' VAL . 0.1 OUTLIER -41.08 -30.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' B' ' 31' ' ' GLU . 0.3 OUTLIER -63.75 -64.29 0.93 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.303 179.843 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.787 HD21 ' CG ' ' B' ' 17' ' ' TYR . 4.2 mm? -46.01 -40.32 10.34 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.33 -0.856 . . . . 0.0 109.65 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.878 HG21 ' CG2' ' B' ' 53' ' ' VAL . 1.7 mp -62.18 -41.82 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.068 -1.02 . . . . 0.0 109.945 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -82.14 -73.81 0.37 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.033 -1.042 . . . . 0.0 111.394 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . 0.426 ' C ' ' ND2' ' B' ' 38' ' ' ASN . 0.1 OUTLIER -68.18 -1.15 5.52 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.032 -1.043 . . . . 0.0 111.465 -178.071 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.562 ' HG2' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -131.03 -9.68 3.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.7 -1.25 . . . . 0.0 110.313 -179.92 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.768 HD11 ' HE3' ' A' ' 7' ' ' MET . 1.6 tp -141.48 78.3 1.63 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.705 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . 0.427 ' O ' ' O ' ' B' ' 42' ' ' HIS . 0.1 OUTLIER -123.12 -19.89 5.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.151 -0.968 . . . . 0.0 109.739 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . 0.55 ' CE1' ' OE2' ' A' ' 4' ' ' GLU . 0.1 OUTLIER -47.68 -92.09 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.136 -0.977 . . . . 0.0 109.297 -179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -89.6 12.29 17.17 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.188 -0.945 . . . . 0.0 109.183 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.898 HD11 ' O ' ' B' ' 80' ' ' VAL . 4.2 mm? -92.81 -36.35 12.91 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.341 -0.849 . . . . 0.0 109.451 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' B' ' 44' ' ' LEU . 49.4 mt-10 60.67 147.41 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.241 -0.912 . . . . 0.0 109.296 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.47 ' O ' ' N ' ' B' ' 48' ' ' LYS . 1.1 mm-40 -43.91 139.04 2.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.243 -0.911 . . . . 0.0 109.45 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.702 ' CD1' HG21 ' B' ' 53' ' ' VAL . 2.0 mt -43.86 98.08 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.334 -0.854 . . . . 0.0 109.12 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.472 ' O ' ' CG ' ' B' ' 49' ' ' GLU . 0.0 OUTLIER -42.47 -31.85 0.48 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.753 -179.747 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.472 ' CG ' ' O ' ' B' ' 48' ' ' LYS . 0.9 OUTLIER 171.39 65.27 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.216 -0.928 . . . . 0.0 109.405 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' B' ' 54' ' ' ASP . 0.1 OUTLIER 47.97 48.35 18.07 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.211 -0.931 . . . . 0.0 109.193 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.449 ' OE1' ' HG3' ' B' ' 48' ' ' LYS . 0.4 OUTLIER -90.05 -64.1 1.19 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 1.022 ' CG1' HG13 ' B' ' 80' ' ' VAL . 1.3 t -90.83 -20.9 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.19 -0.944 . . . . 0.0 109.692 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.005 HG11 ' HD3' ' B' ' 33' ' ' LYS . 37.6 t -82.92 -31.35 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 120.803 -1.185 . . . . 0.0 108.993 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 50' ' ' GLN . 0.1 OUTLIER -90.54 -27.67 19.01 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.287 -0.883 . . . . 0.0 109.15 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -86.51 -46.09 10.49 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.333 -0.855 . . . . 0.0 109.447 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 1.134 HG22 HD21 ' B' ' 60' ' ' LEU . 1.2 p -63.52 -41.41 92.56 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.037 -1.04 . . . . 0.0 108.904 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.552 ' CE ' HD13 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.49 -49.25 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.852 -0.53 . . . . 0.0 109.658 179.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -61.7 -44.85 96.14 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.453 ' C ' HD23 ' B' ' 60' ' ' LEU . 34.2 m -65.74 -13.74 59.94 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.436 -0.79 . . . . 0.0 109.793 179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 1.134 HD21 HG22 ' B' ' 56' ' ' VAL . 2.4 mt -87.17 -44.94 11.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.037 -1.039 . . . . 0.0 109.169 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.449 ' OD1' ' O ' ' B' ' 57' ' ' MET . 8.3 m-20 -42.75 112.35 0.35 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.605 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -44.44 -45.58 9.16 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.31 -0.869 . . . . 0.0 109.611 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -155.18 19.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.169 -0.957 . . . . 0.0 109.762 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.13 95.5 2.28 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 t0 179.8 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.275 -1.132 . . . . 0.0 108.442 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 -21.21 28.94 Favored Glycine 0 N--CA 1.484 1.892 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' B' ' 26' ' ' LYS . 5.3 mm-40 -69.88 108.1 3.84 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.233 -1.157 . . . . 0.0 109.29 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.803 ' SG ' HD13 ' B' ' 27' ' ' LEU . 0.4 OUTLIER -69.69 128.1 35.26 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.215 -0.928 . . . . 0.0 109.727 -179.548 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.512 ' N ' ' OE1' ' B' ' 72' ' ' GLU . 9.1 m-20 -100.55 170.3 8.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.27 -0.894 . . . . 0.0 108.649 179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.41 ' CD1' HG21 ' A' ' 82' ' ' THR . 0.8 OUTLIER -60.29 -59.37 5.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.757 -1.214 . . . . 0.0 110.148 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.523 ' HA ' ' HG2' ' B' ' 74' ' ' MET . 2.4 mt-30 -52.44 -24.69 8.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.046 -1.034 . . . . 0.0 109.084 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' B' ' 60' ' ' LEU . 0.1 OUTLIER -76.95 -38.15 53.85 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.349 -0.845 . . . . 0.0 109.389 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.549 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 24.7 t80 -68.46 -48.79 63.6 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.197 -0.939 . . . . 0.0 109.092 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.7 ' HB3' ' HB1' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -54.24 -46.48 72.58 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.307 -0.87 . . . . 0.0 109.337 179.818 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.505 ' N ' ' SD ' ' B' ' 74' ' ' MET . . . -74.73 -20.1 59.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.165 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.774 ' HB2' HD22 ' B' ' 60' ' ' LEU . 0.4 OUTLIER -72.73 -71.11 0.31 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 109.233 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.642 HG21 ' CD2' ' A' ' 3' ' ' LEU . 53.1 t -57.54 -31.29 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.274 -0.891 . . . . 0.0 109.111 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.539 ' CB ' ' HB2' ' A' ' 74' ' ' MET . . . -59.76 -42.06 92.41 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.338 -0.851 . . . . 0.0 109.227 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.667 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 3.9 mmm -73.63 -70.06 0.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.284 -0.885 . . . . 0.0 109.618 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 1.022 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.0 OUTLIER -44.32 -25.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 120.891 -1.13 . . . . 0.0 109.591 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.42 ' N ' ' O ' ' B' ' 79' ' ' MET . 11.8 m -70.96 -67.74 0.49 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.973 -1.079 . . . . 0.0 108.885 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.585 ' OG1' ' CG ' ' A' ' 70' ' ' PHE . 0.9 OUTLIER -82.98 -52.95 6.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 179.057 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -36.09 -31.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.261 0.553 . . . . 0.0 109.881 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' B' ' 82' ' ' THR . 41.4 t -72.78 -52.69 13.97 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.25 -0.906 . . . . 0.0 109.565 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -68.25 -9.91 50.71 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.266 -0.896 . . . . 0.0 109.583 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -81.85 -20.15 39.55 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.24 -0.912 . . . . 0.0 109.48 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.472 ' O ' ' HG3' ' B' ' 89' ' ' GLU . 0.2 OUTLIER -58.83 -38.24 78.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.489 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.46 ' O ' ' CB ' ' B' ' 89' ' ' GLU . 0.2 OUTLIER -54.84 -33.41 61.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' B' ' 87' ' ' PHE . 3.4 mt-10 73.54 91.98 0.08 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.294 -0.879 . . . . 0.0 109.5 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 89' ' ' GLU . 2.1 m80 55.37 169.77 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.46 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 118.0 -1.0 . . . . 0.0 109.453 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.508 ' N ' ' HB3' ' A' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 1.013 ' HG3' ' HB1' ' B' ' 9' ' ' ALA . 3.0 tt0 -64.32 -50.41 67.94 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.266 -0.896 . . . . 0.0 109.468 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.678 HD21 HG11 ' B' ' 13' ' ' VAL . 1.2 mp -79.94 -27.5 39.79 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.249 -0.907 . . . . 0.0 109.57 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' B' ' 39' ' ' GLU . 37.7 tt0 -60.99 -50.54 72.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 109.525 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -52.88 15.62 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.297 -0.877 . . . . 0.0 109.251 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.747 ' HB1' HD23 ' B' ' 10' ' ' LEU . . . -61.9 -13.26 23.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.219 -0.926 . . . . 0.0 109.504 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.524 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 42.3 ttp -80.09 -59.08 2.85 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.219 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 12' ' ' ASP . 75.9 t -57.09 -24.51 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.224 -0.923 . . . . 0.0 109.266 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.11 -51.82 9.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.61 HD23 HD11 ' B' ' 3' ' ' LEU . 0.4 OUTLIER -57.53 -60.66 3.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 109.426 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.669 HG23 ' HZ ' ' A' ' 70' ' ' PHE . 6.9 mt -53.06 -43.97 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.274 -0.891 . . . . 0.0 109.227 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 9.3 m-20 -54.16 -37.18 64.16 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.375 -0.828 . . . . 0.0 109.247 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.821 HG22 ' CE1' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -66.29 -39.77 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.18 -0.95 . . . . 0.0 109.188 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -53.74 -62.85 1.38 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.985 -1.072 . . . . 0.0 108.286 179.586 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -66.19 -10.04 37.61 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.291 -0.881 . . . . 0.0 109.13 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 13' ' ' VAL . 1.7 tp60 -67.26 -66.69 0.53 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 109.91 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 1.006 ' CE2' HD22 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -125.05 35.35 4.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.697 -1.252 . . . . 0.0 110.708 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.781 ' OG ' HD21 ' A' ' 27' ' ' LEU . 37.6 m -91.4 -22.36 20.51 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.922 -1.111 . . . . 0.0 109.201 179.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.507 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -103.36 20.72 41.6 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -60.42 -61.91 2.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -1.132 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -122.87 164.83 17.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.431 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.39 -128.62 11.63 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.565 ' HB2' ' CE1' ' A' ' 25' ' ' HIS . 3.9 m-20 -88.99 -148.81 0.18 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -1.144 . . . . 0.0 109.46 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 14.9 ttpt -145.04 65.81 1.26 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 109.476 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.565 ' CE1' ' HB2' ' A' ' 23' ' ' ASP . 2.8 p80 -170.33 -34.22 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.227 -0.921 . . . . 0.0 109.969 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.538 ' CD ' ' HB3' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -125.46 170.4 11.44 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.135 -0.978 . . . . 0.0 110.006 -179.524 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.781 HD21 ' OG ' ' A' ' 18' ' ' SER . 8.1 mt -104.19 170.52 7.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.425 -0.797 . . . . 0.0 109.929 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -133.54 69.89 1.47 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.317 -0.864 . . . . 0.0 109.667 179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 65.21 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.59 -0.694 . . . . 0.0 111.064 179.121 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 m -46.14 -42.32 13.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 110.594 -178.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.832 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.8 mm-40 -59.86 -40.31 88.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.932 -1.105 . . . . 0.0 108.919 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.747 ' CD2' HD13 ' A' ' 60' ' ' LEU . 1.5 mp -55.76 -60.18 3.81 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.637 ' CG ' HG11 ' A' ' 53' ' ' VAL . 9.1 mttt -41.56 -50.97 4.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.237 -0.914 . . . . 0.0 109.93 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.521 ' O ' ' CB ' ' A' ' 38' ' ' ASN . 0.2 OUTLIER -60.23 -39.42 86.62 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.998 -1.064 . . . . 0.0 110.126 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.006 HD22 ' CE2' ' A' ' 17' ' ' TYR . 3.8 mm? -52.71 -56.58 14.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.463 -0.773 . . . . 0.0 110.263 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 1.056 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mp -94.29 -57.02 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 120.93 -1.106 . . . . 0.0 109.788 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.95 ' ND2' HD11 ' A' ' 47' ' ' ILE . 1.6 m120 -43.96 -26.19 0.26 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.162 -0.961 . . . . 0.0 109.565 -179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 34' ' ' GLU . 5.4 t30 -99.82 -41.91 7.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.151 -0.968 . . . . 0.0 109.627 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.539 ' CB ' ' HB2' ' B' ' 3' ' ' LEU . 58.0 mm-40 -72.05 -62.78 1.31 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 109.603 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.056 HD13 HG23 ' A' ' 36' ' ' ILE . 5.9 mp -41.71 -65.74 0.42 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.394 -0.817 . . . . 0.0 109.57 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 t 51.21 21.54 1.12 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.258 -0.901 . . . . 0.0 109.447 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 8.5 t60 -153.01 -73.98 0.13 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.272 -0.893 . . . . 0.0 109.515 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.467 ' CE2' HG23 ' A' ' 81' ' ' THR . 0.1 OUTLIER -44.11 -26.5 0.3 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.23 -0.919 . . . . 0.0 109.499 -179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.855 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.9 OUTLIER -167.52 76.82 0.16 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -44.02 111.58 0.31 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.225 -0.922 . . . . 0.0 109.418 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.66 ' O ' HD13 ' A' ' 47' ' ' ILE . 35.0 mt-10 60.93 -164.13 0.24 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.882 . . . . 0.0 109.381 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 1.0 HG13 HG21 ' A' ' 53' ' ' VAL . 45.0 mm -127.66 74.26 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.197 -0.939 . . . . 0.0 109.563 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -42.8 -44.09 4.28 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.417 -0.802 . . . . 0.0 109.342 179.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.66 ' O ' HG22 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -127.47 153.13 46.68 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.379 -0.826 . . . . 0.0 109.126 179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' A' ' 54' ' ' ASP . 1.6 pt20 -85.76 55.55 3.57 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.28 -0.888 . . . . 0.0 109.413 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.52 -45.6 8.84 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 109.954 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.859 HG11 ' HA ' ' A' ' 80' ' ' VAL . 0.5 OUTLIER -98.66 -25.78 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.035 . . . . 0.0 110.076 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.0 HG21 HG13 ' A' ' 47' ' ' ILE . 52.0 t -81.92 -24.73 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 120.812 -1.18 . . . . 0.0 109.354 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -90.23 -37.06 14.38 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.167 -0.958 . . . . 0.0 108.916 179.247 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -78.26 -47.39 18.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.426 -0.796 . . . . 0.0 109.268 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.687 HG13 HD12 ' A' ' 60' ' ' LEU . 2.9 p -59.12 -44.33 91.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.519 ' N ' ' CG1' ' A' ' 56' ' ' VAL . 10.7 tpt -41.8 -48.76 4.36 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.603 -0.686 . . . . 0.0 109.949 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -57.16 -56.35 22.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.183 -0.948 . . . . 0.0 109.422 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 59' ' ' THR . 7.8 m -66.54 -8.67 28.29 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.306 -0.871 . . . . 0.0 109.574 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.813 HD22 ' OE1' ' A' ' 72' ' ' GLU . 63.7 mt -96.15 -17.29 20.95 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 -179.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 62' ' ' ASN . 8.9 m-20 -59.1 113.37 2.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.167 -0.958 . . . . 0.0 109.393 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' OD1' ' OD2' ' A' ' 69' ' ' ASP . 14.5 t30 -43.5 -47.75 7.25 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 109.535 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -165.84 40.86 0.06 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.41 87.8 0.27 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.7 -33.41 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.311 -1.111 . . . . 0.0 108.632 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 -19.22 27.56 Favored Glycine 0 N--CA 1.485 1.94 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HB3' ' CD ' ' A' ' 26' ' ' LYS . 1.3 mt-10 -71.79 103.2 3.04 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -1.149 . . . . 0.0 109.41 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' CYS . . . . . 0.541 ' SG ' ' CG ' ' A' ' 72' ' ' GLU . 0.0 OUTLIER -70.05 137.02 50.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.303 -0.873 . . . . 0.0 109.258 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 6.5 m-20 -116.85 170.56 8.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.416 -0.803 . . . . 0.0 109.163 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.669 ' HZ ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -52.08 -50.42 61.59 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.056 -1.028 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.562 ' O ' ' HE3' ' A' ' 74' ' ' MET . 0.0 OUTLIER -48.49 -35.73 13.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.259 -0.901 . . . . 0.0 109.155 -179.716 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.813 ' OE1' HD22 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.53 -31.84 47.72 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.969 -1.082 . . . . 0.0 109.369 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.678 ' CD2' ' CD2' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -53.55 -51.48 62.76 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.977 -1.077 . . . . 0.0 108.966 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.807 ' HE3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -67.13 -38.36 85.42 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.401 -0.812 . . . . 0.0 109.353 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.807 ' HB2' ' HE3' ' A' ' 74' ' ' MET . . . -68.47 -15.76 63.66 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.081 -1.012 . . . . 0.0 108.866 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.63 ' O ' HG23 ' A' ' 80' ' ' VAL . 1.0 OUTLIER -82.7 -72.29 0.45 Allowed 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.388 -0.82 . . . . 0.0 109.216 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.567 ' CG2' HD23 ' B' ' 3' ' ' LEU . 54.1 t -54.28 -32.92 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 O-C-N 121.226 -0.921 . . . . 0.0 108.921 179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 74' ' ' MET . . . -65.38 -42.02 93.14 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.508 -0.745 . . . . 0.0 109.849 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.721 ' O ' ' HB3' ' A' ' 83' ' ' ALA . 41.6 mmm -77.53 -71.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.914 -1.116 . . . . 0.0 110.089 -179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.859 ' HA ' HG11 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -45.07 -23.14 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 O-C-N 120.436 -1.415 . . . . 0.0 109.83 -178.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.612 HG21 HD11 ' B' ' 11' ' ' ILE . 18.5 m -80.77 -66.28 0.9 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.816 -1.178 . . . . 0.0 108.643 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.573 ' CG2' ' N ' ' A' ' 83' ' ' ALA . 1.4 t -80.75 -50.2 10.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 108.596 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' A' ' 79' ' ' MET . . . -38.38 -41.51 0.64 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.758 -0.589 . . . . 0.0 109.739 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 16.4 t -63.78 -49.51 72.66 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.262 -0.899 . . . . 0.0 109.598 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.51 -21.67 64.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.522 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -90.04 -21.98 22.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.26 -67.3 0.26 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.298 -0.876 . . . . 0.0 109.512 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.53 ' O ' ' CG ' ' A' ' 89' ' ' GLU . 38.7 m-85 -57.56 -69.37 0.17 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.253 -0.904 . . . . 0.0 109.471 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.53 ' CG ' ' O ' ' A' ' 88' ' ' PHE . 10.9 pt-20 41.84 29.14 0.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.487 -0.758 . . . . 0.0 109.642 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' N ' ' O ' ' A' ' 88' ' ' PHE . 11.5 m-70 -76.19 153.47 36.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 118.013 -0.994 . . . . 0.0 109.452 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.409 ' CB ' ' HB3' ' B' ' 4' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -76.34 0.09 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 0.0 109.49 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.61 HD11 HD23 ' A' ' 10' ' ' LEU . 2.8 mp -62.48 -15.75 51.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.232 -0.918 . . . . 0.0 109.431 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.438 ' O ' HG23 ' B' ' 8' ' ' VAL . 1.6 tp10 -73.01 -69.03 0.44 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' B' ' 8' ' ' VAL . 0.0 OUTLIER -58.97 -49.57 77.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 109.322 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' B' ' 7' ' ' MET . . . -54.89 -56.42 19.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.325 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' MET . . . . . 0.523 ' CB ' ' O ' ' B' ' 3' ' ' LEU . 15.5 ttp -43.83 -39.0 3.59 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.385 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 4' ' ' GLU . 87.0 t -61.28 -48.86 87.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.425 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . 1.013 ' HB1' ' HG3' ' A' ' 2' ' ' GLU . . . -62.02 -61.48 2.45 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.565 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' LEU . . . . . 1.006 HD12 ' CZ ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -43.43 -39.12 3.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.312 -0.867 . . . . 0.0 109.489 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.801 HD13 ' HZ ' ' B' ' 70' ' ' PHE . 13.5 mm -61.66 -51.51 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.164 -0.96 . . . . 0.0 109.128 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' B' ' 16' ' ' GLN . 6.9 t0 -58.95 -17.06 21.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.321 -0.862 . . . . 0.0 109.229 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.759 HG13 ' CD2' ' B' ' 35' ' ' LEU . 1.3 t -76.5 -53.18 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.286 -0.884 . . . . 0.0 109.166 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.674 ' CD2' ' CD2' ' B' ' 70' ' ' PHE . 7.8 t80 -55.1 -50.98 67.84 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.812 -1.18 . . . . 0.0 109.384 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -63.84 1.0 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.166 -0.959 . . . . 0.0 109.93 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.447 ' HB3' ' O ' ' B' ' 12' ' ' ASP . 0.9 OUTLIER -45.31 -68.73 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.806 -179.604 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.637 ' HE2' HG22 ' B' ' 13' ' ' VAL . 23.4 m-85 -42.73 -34.12 0.86 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.384 -0.822 . . . . 0.0 109.722 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' SER . . . . . 0.536 ' O ' ' CB ' ' B' ' 24' ' ' LYS . 0.3 OUTLIER -85.69 50.0 1.88 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.19 -0.944 . . . . 0.0 109.294 179.762 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.61 -44.3 1.7 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -23.06 21.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.326 -1.103 . . . . 0.0 109.456 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' B' ' 23' ' ' ASP . 0.0 OUTLIER -69.84 102.47 1.95 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.213 -0.929 . . . . 0.0 109.504 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 21' ' ' GLU . . . 44.1 -95.84 0.01 OUTLIER Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' B' ' 21' ' ' GLU . 0.4 OUTLIER -112.49 -81.23 0.59 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.234 -1.157 . . . . 0.0 109.411 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' B' ' 18' ' ' SER . 0.1 OUTLIER 175.77 56.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.261 -0.899 . . . . 0.0 109.378 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -136.88 6.63 2.91 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.189 -0.944 . . . . 0.0 109.7 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.554 ' O ' HD23 ' B' ' 27' ' ' LEU . 0.0 OUTLIER -170.1 170.53 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.126 -0.984 . . . . 0.0 109.689 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.873 HD13 HD11 ' B' ' 35' ' ' LEU . 26.1 mt -126.54 130.74 51.16 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.235 -0.915 . . . . 0.0 110.122 -179.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.477 ' O ' ' C ' ' B' ' 29' ' ' LYS . 3.2 ttmt -69.67 154.03 42.57 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.809 ' HA ' HD12 ' B' ' 32' ' ' LEU . 0.0 OUTLIER -39.45 -32.04 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.314 -0.866 . . . . 0.0 109.718 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . 0.422 ' N ' ' O ' ' B' ' 28' ' ' LYS . 0.8 OUTLIER -76.31 -46.58 27.09 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.322 -0.861 . . . . 0.0 109.481 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.732 ' O ' HD12 ' B' ' 35' ' ' LEU . 0.4 OUTLIER -52.67 -42.96 65.21 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.179 -0.951 . . . . 0.0 108.988 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.825 HD21 ' CB ' ' B' ' 68' ' ' CYS . 5.6 mt -60.3 -66.32 0.54 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.648 -0.657 . . . . 0.0 109.306 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.629 ' CD ' HG11 ' B' ' 53' ' ' VAL . 0.6 OUTLIER -42.88 -27.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 109.364 179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -66.53 -51.59 54.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.304 -0.873 . . . . 0.0 109.329 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.873 HD11 HD13 ' B' ' 27' ' ' LEU . 2.3 mp -56.77 -42.12 78.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.263 -0.898 . . . . 0.0 109.475 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.546 HG23 ' HB2' ' B' ' 40' ' ' LEU . 3.4 mt -79.91 -14.13 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.268 -0.895 . . . . 0.0 109.563 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' B' ' 33' ' ' LYS . 0.9 OUTLIER -89.38 -14.73 34.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 109.533 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -99.69 -35.43 9.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.248 -0.908 . . . . 0.0 109.507 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.555 ' OE1' HD12 ' B' ' 40' ' ' LEU . 3.2 tm-20 -110.31 -10.01 14.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.249 -0.907 . . . . 0.0 109.505 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' B' ' 81' ' ' THR . 0.3 OUTLIER -131.6 68.08 1.5 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.233 -0.917 . . . . 0.0 109.58 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.99 -9.99 13.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.09 -44.28 2.92 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.256 -0.902 . . . . 0.0 109.465 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.24 -47.94 46.09 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.251 -0.906 . . . . 0.0 109.404 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.751 HD13 HD13 ' B' ' 47' ' ' ILE . 0.4 OUTLIER -117.11 40.66 2.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.904 . . . . 0.0 109.353 179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 45.44 -150.07 0.07 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.214 -0.929 . . . . 0.0 109.431 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -85.22 45.04 1.14 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.399 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.751 HD13 HD13 ' B' ' 44' ' ' LEU . 9.0 mm 60.99 20.85 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.295 -0.878 . . . . 0.0 109.568 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' B' ' 49' ' ' GLU . 1.4 mttt 43.81 32.68 0.62 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.124 -0.985 . . . . 0.0 109.382 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 50.8 tt0 83.14 -43.1 0.11 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.63 -0.668 . . . . 0.0 109.878 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.506 ' CG ' ' HB2' ' B' ' 54' ' ' ASP . 0.8 OUTLIER 176.22 56.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.026 -1.046 . . . . 0.0 109.645 180.0 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -90.55 -69.7 0.71 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -0.932 . . . . 0.0 109.529 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.952 ' CG1' HG13 ' B' ' 80' ' ' VAL . 17.0 t -85.56 -22.22 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.196 -0.94 . . . . 0.0 109.688 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.657 ' CG2' HG21 ' B' ' 47' ' ' ILE . 47.8 t -78.86 -36.02 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.147 -0.97 . . . . 0.0 109.366 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.506 ' HB2' ' CG ' ' B' ' 50' ' ' GLN . 23.7 t70 -76.58 -35.66 58.03 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.252 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -73.53 -45.68 52.22 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.879 . . . . 0.0 109.385 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' VAL . . . . . 1.059 HG21 ' CZ ' ' B' ' 76' ' ' PHE . 25.9 m -59.77 -43.36 91.5 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.147 -0.97 . . . . 0.0 109.69 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . 0.496 ' N ' HG23 ' B' ' 56' ' ' VAL . 0.0 OUTLIER -41.62 -28.11 0.12 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.972 -1.08 . . . . 0.0 109.419 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' B' ' 56' ' ' VAL . 2.6 tm-20 -83.63 -46.25 12.55 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' THR . . . . . 0.477 ' O ' ' C ' ' B' ' 60' ' ' LEU . 7.5 m -68.76 -65.12 0.74 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 109.054 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . 0.644 HD13 ' CD2' ' B' ' 76' ' ' PHE . 21.0 mt -36.44 -62.58 0.45 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.81 -0.556 . . . . 0.0 109.693 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . 0.46 ' OD1' ' HA2' ' B' ' 64' ' ' GLY . 5.1 t70 -56.62 98.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.402 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.456 ' HB2' ' OE2' ' B' ' 72' ' ' GLU . 3.1 m120 -96.33 -11.17 26.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -105.45 -40.67 5.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -0.922 . . . . 0.0 109.479 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.46 ' HA2' ' OD1' ' B' ' 61' ' ' ASP . . . 101.82 95.39 2.26 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 176.71 -32.48 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.211 -1.17 . . . . 0.0 108.61 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' GLY . . . . . . . . . . . . . . . 110.16 12.82 16.85 Favored Glycine 0 N--CA 1.486 1.97 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . 0.523 ' HB2' ' CB ' ' B' ' 26' ' ' LYS . 20.0 pt-20 -110.39 116.51 31.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.24 -1.153 . . . . 0.0 109.337 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' CYS . . . . . 0.825 ' CB ' HD21 ' B' ' 32' ' ' LEU . 9.0 t -73.04 152.77 41.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.2 -0.937 . . . . 0.0 109.765 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.463 ' HB2' ' HG3' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -115.38 171.8 7.48 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.801 ' HZ ' HD13 ' B' ' 11' ' ' ILE . 1.0 OUTLIER -55.34 -51.46 66.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.123 -0.986 . . . . 0.0 110.305 -179.669 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . 0.476 ' OE1' ' HG2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -59.98 -36.33 76.93 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.314 -0.867 . . . . 0.0 108.975 -179.698 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.476 ' HG2' ' OE1' ' B' ' 71' ' ' GLN . 3.4 mt-10 -79.82 -13.12 59.64 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.091 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 1.006 ' CZ ' HD12 ' B' ' 10' ' ' LEU . 0.0 OUTLIER -73.88 -60.35 2.3 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.654 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . 0.567 ' SD ' ' CE2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -67.78 -24.43 65.32 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.524 ' N ' ' SD ' ' A' ' 74' ' ' MET . . . -70.14 -30.54 67.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.301 -0.874 . . . . 0.0 108.731 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 1.059 ' CZ ' HG21 ' B' ' 56' ' ' VAL . 0.8 OUTLIER -75.71 -69.02 0.51 Allowed 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.226 179.637 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.607 HG21 HD22 ' A' ' 3' ' ' LEU . 42.9 t -49.22 -36.12 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.321 -0.862 . . . . 0.0 109.408 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.54 ' CB ' ' HG2' ' A' ' 74' ' ' MET . . . -66.17 -38.39 87.95 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.873 . . . . 0.0 110.438 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.73 ' O ' ' HB3' ' B' ' 83' ' ' ALA . 58.5 mtm -78.2 -71.35 0.43 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.888 -1.133 . . . . 0.0 109.795 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' VAL . . . . . 0.952 HG13 ' CG1' ' B' ' 52' ' ' VAL . 0.1 OUTLIER -45.41 -23.49 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 O-C-N 120.452 -1.405 . . . . 0.0 109.585 -179.13 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . 0.952 ' HA ' HD21 ' B' ' 40' ' ' LEU . 11.8 m -79.09 -67.27 0.77 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.926 -1.109 . . . . 0.0 108.678 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' THR . . . . . 0.58 ' CG2' ' N ' ' B' ' 83' ' ' ALA . 1.2 t -80.71 -50.74 9.5 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.206 -0.934 . . . . 0.0 108.615 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.73 ' HB3' ' O ' ' B' ' 79' ' ' MET . . . -38.01 -31.21 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 CA-C-O 121.331 0.586 . . . . 0.0 109.657 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' B' ' 82' ' ' THR . 48.2 t -85.25 -43.59 13.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.275 -0.891 . . . . 0.0 109.516 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' HIS . . . . . 0.412 ' N ' ' O ' ' B' ' 82' ' ' THR . 54.4 t-80 -48.07 -33.51 8.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.523 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' B' ' 87' ' ' PHE . 2.0 tt0 -87.97 -28.36 21.51 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.525 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.448 ' HB2' ' HA ' ' B' ' 84' ' ' CYS . 0.2 OUTLIER -44.05 -50.58 8.36 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.243 -0.911 . . . . 0.0 109.502 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -52.37 -67.51 0.25 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.223 -0.923 . . . . 0.0 109.405 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.8 176.34 4.32 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -151.93 136.74 17.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.275 -0.89 . . . . 0.0 109.497 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.416 179.974 . . . . . . . . 1 1 . 1 stop_ save_